2-[[2-carboxyethyl-(3,4-dimethylphenyl)amino]methyl]benzoic acid

Systemtic Name: 2-[[2-carboxyethyl-(3,4-dimethylphenyl)amino]methyl]benzoic acid Openeye Name: 2-[[N-(2-carboxyethyl)-3,4-dimethyl-anilino]methyl]benzoic acid CAS Name: 2-[[N-(2-carboxyethyl)-3,4-dimethylanilino]methyl]benzoic acid IUPAC Name: 2-[[N-(2-carboxyethyl)-3,4-dimethylanilino]methyl]benzoic acid Traditional Name: 2-[[N-(2-carboxyethyl)-3,4-dimethyl-anilino]methyl]benzoic acid Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CCC(=O)O)CC2=CC=CC=C2C(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CCC(=O)O)CC2=CC=CC=C2C(=O)O)C

InChI

InChI=1S/C19H21NO4/c1-13-7-8-16(11-14(13)2)20(10-9-18(21)22)12-15-5-3-4-6-17(15)19(23)24/h3-8,11H,9-10,12H2,1-2H3,(H,21,22)(H,23,24)