2-azanyl-5-[[3-carboxy-4-[(3-methoxyphenyl)amino]phenyl]methyl]benzoic acid

Systemtic Name: 2-azanyl-5-[[3-carboxy-4-[(3-methoxyphenyl)amino]phenyl]methyl]benzoic acid Openeye Name: 2-amino-5-[[3-carboxy-4-(3-methoxyanilino)phenyl]methyl]benzoic acid CAS Name: 2-amino-5-[[3-carboxy-4-(3-methoxyanilino)phenyl]methyl]benzoic acid IUPAC Name: 2-amino-5-[[3-carboxy-4-(3-methoxyanilino)phenyl]methyl]benzoic acid Traditional Name: 2-amino-5-[3-carboxy-4-(m-anisidino)benzyl]benzoic acid Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=C(C=C(C=C2)CC3=CC(=C(C=C3)N)C(=O)O)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)NC2=C(C=C(C=C2)CC3=CC(=C(C=C3)N)C(=O)O)C(=O)O

InChI

InChI=1S/C22H20N2O5/c1-29-16-4-2-3-15(12-16)24-20-8-6-14(11-18(20)22(27)28)9-13-5-7-19(23)17(10-13)21(25)26/h2-8,10-12,24H,9,23H2,1H3,(H,25,26)(H,27,28)