4-[[(3-acetamidophenyl)-[(4-carboxyphenyl)methyl]amino]methyl]benzoic acid

Systemtic Name: 4-[[(3-acetamidophenyl)-[(4-carboxyphenyl)methyl]amino]methyl]benzoic acid Openeye Name: 4-[[3-acetamido-N-[(4-carboxyphenyl)methyl]anilino]methyl]benzoic acid CAS Name: 4-[[3-acetamido-N-[(4-carboxyphenyl)methyl]anilino]methyl]benzoic acid IUPAC Name: 4-[[3-acetamido-N-[(4-carboxyphenyl)methyl]anilino]methyl]benzoic acid Traditional Name: 4-[(3-acetamido-N-(4-carboxybenzyl)anilino)methyl]benzoic acid Formula: C24H22N2O5 MolecularWeight: 418.44188

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)N(CC2=CC=C(C=C2)C(=O)O)CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)N(CC2=CC=C(C=C2)C(=O)O)CC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C24H22N2O5/c1-16(27)25-21-3-2-4-22(13-21)26(14-17-5-9-19(10-6-17)23(28)29)15-18-7-11-20(12-8-18)24(30)31/h2-13H,14-15H2,1H3,(H,25,27)(H,28,29)(H,30,31)