3-carboxy-4-hydroxy-benzenesulfonate; 6,7-dimethoxy-2-methyl-1-[1-(4-nitrophenyl)propan-2-yl]-3,4-dihydro-1H-isoquinoline
Molecular Formula:
C28H32N2O10S
InChI: InChI=1/C21H26N2O4.C7H6O6S/c1-14(11-15-5-7-17(8-6-15)23(24)25)21-18-13-20(27-4)19(26-3)12-16(18)9-10-22(21)2;8-6-2-1-4(14(11,12)13)3-5(6)7(9)10/h5-8,12-14,21H,9-11H2,1-4H3;1-3,8H,(H,9,10)(H,11,12,13)/fC21H27N2O4.C7H5O6S/h22H;9H/q+1;-1
InChIKey: InChIKey=JEPRBUKYZNSROP-UVDGFUABCZ
SMILES: CC(CC1=CC=C(C=C1)[N+](=O)[O-])C2C3=CC(=C(C=C3CC[NH+]2C)OC)OC.C1=CC(=C(C=C1S(=O)(=O)[O-])C(=O)O)O
Names:
Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-(alpha-methyl-4-nitro)phenethyl-, hydrogen sulfosalicylate
ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-2-METHYL-1-(alpha-METHYL-4-NITRO)
3-carboxy-4-hydroxy-benzenesulfonate; 6,7-dimethoxy-2-methyl-1-[1-(4-nitrophenyl)propan-2-yl]-3,4-dihydro-1H-isoquinoline
63937-54-2
Registries:
PubChem CID 45487
PubChem ID 185400
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