EINECS 267-485-0

Molecular Formula: C₉₇H₉₆N₁₀O₁₈S₂

InChI: InChI=1/3C27H28N2O3.C16H12N4O9S2/c3*1-6-28-22-14-24-20(12-16(22)3)26(18-10-8-9-11-19(18)27(30)31-5)21-13-17(4)23(29-7-2)15-25(21)32-24;21-15-13(18-17-9-1-5-11(6-2-9)30(24,25)26)14(16(22)23)19-20(15)10-3-7-12(8-4-10)31(27,28)29/h3*8-15,28H,6-7H2,1-5H3;1-8,13H,(H,22,23)(H,24,25,26)(H,27,28,29)/b3*29-23+;/f3C27H29N2O3.C16H9N4O9S2/h3*29H;/q3*+1;-3/b

InChIKey: InChIKey=VFASXDBHIQDBDT-UZWHRPKADO
SMILES: CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OC)C)C.CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OC)C)C.CCNC1=C(C=C2C(=C1)OC3=CC(=[NH+]CC)C(=CC3=C2C4=CC=CC=C4C(=O)OC)C)C.C1=CC(=CC=C1N=NC2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)[O-])C(=O)[O-])S(=O)(=O)[O-]

Names:
    EINECS 267-485-0
    ethyl-[6-ethylamino-9-(2-methoxycarbonylphenyl)-2,7-dimethyl-xanthen-3-ylidene]azanium; 5-oxo-1-(4-sulfonatophenyl)-4-(4-sulfonatophenyl)diazenyl-4H-pyrazole-3-carboxylate
    Xanthylium, 3,6-bis(ethylamino)-9-(2-(methoxycarbonyl)phenyl)-2,7-dimethyl-, salt with 4,5-dihydro-5-oxo-1-(4-sulfophenyl)-4-((4-sulfophenyl)azo)-1H-pyrazole-3-carboxylic acid (3:1)
    2-Pyrazoline-3-carboxylic acid, 5-oxo-1-(p-sulfophenyl)-4-((p-sulfophenyl)azo)-, compd. with methyl o-(6-(ethylamino)-3-(ethylimino)-2,7-dimethyl-3H-xanthen-9-yl)benzoate (1:3)
    3,6-Bis(ethylamino)-9-(2-(methoxycarbonyl)phenyl)-2,7-dimethylxanthylium, salt with 4,5-dihydro-5-oxo-1-(4-sulphophenyl)-4-((4-sulphophenyl)azo)-1H-pyrazole-3-carboxylic acid (3:1)
    67874-58-2

Registries:
    PubChem CID 11979404
    PubChem ID 207194