(Z)-but-2-enedioate; [(4-chlorophenyl)-phenyl-methyl]-[2-(2,6-dimethylphenyl)ammonioethyl]azanium
Molecular Formula:
C27H29ClN2O4
InChI: InChI=1/C23H25ClN2.C4H4O4/c1-17-7-6-8-18(2)22(17)25-15-16-26-23(19-9-4-3-5-10-19)20-11-13-21(24)14-12-20;5-3(6)1-2-4(7)8/h3-14,23,25-26H,15-16H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/fC23H27ClN2.C4H2O4/h25-26H;/q+2;-2
InChIKey: InChIKey=AVGXUPVJBLUZCA-HWJBZHPZDP
SMILES: CC1=C(C(=CC=C1)C)[NH2+]CC[NH2+]C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.C(=CC(=O)[O-])C(=O)[O-]
Names:
(Z)-but-2-enedioate; [(4-chlorophenyl)-phenyl-methyl]-[2-(2,6-dimethylphenyl)ammonioethyl]azanium
Registries:
PubChem CID 6433827
PubChem ID 11620651
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