4-[[(4-methoxyphenyl)carbonyl-[(4-methylphenyl)methyl]amino]methyl]-3-nitro-benzoic acid

Systemtic Name: 4-[[(4-methoxyphenyl)carbonyl-[(4-methylphenyl)methyl]amino]methyl]-3-nitro-benzoic acid Openeye Name: 4-[[(4-methoxybenzoyl)-(p-tolylmethyl)amino]methyl]-3-nitro-benzoic acid CAS Name: 4-[[[(4-methoxyphenyl)-oxomethyl]-[(4-methylphenyl)methyl]amino]methyl]-3-nitrobenzoic acid IUPAC Name: 4-[[(4-methoxybenzoyl)-[(4-methylphenyl)methyl]amino]methyl]-3-nitrobenzoic acid Traditional Name: 4-[[(4-methylbenzyl)-p-anisoyl-amino]methyl]-3-nitro-benzoic acid Formula: C24H22N2O6 MolecularWeight: 434.44128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H22N2O6/c1-16-3-5-17(6-4-16)14-25(23(27)18-9-11-21(32-2)12-10-18)15-20-8-7-19(24(28)29)13-22(20)26(30)31/h3-13H,14-15H2,1-2H3,(H,28,29)