2-azanyl-3-[(4-carboxyphenyl)methyl]benzoic acid

Systemtic Name: 2-azanyl-3-[(4-carboxyphenyl)methyl]benzoic acid Openeye Name: 2-amino-3-[(4-carboxyphenyl)methyl]benzoic acid CAS Name: 2-amino-3-[(4-carboxyphenyl)methyl]benzoic acid IUPAC Name: 2-amino-3-[(4-carboxyphenyl)methyl]benzoic acid Traditional Name: 2-amino-3-(4-carboxybenzyl)benzoic acid Formula: C15H13NO4 MolecularWeight: 271.26802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)CC2=CC=C(C=C2)C(=O)O)N)C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)CC2=CC=C(C=C2)C(=O)O)N)C(=O)O

InChI

InChI=1S/C15H13NO4/c16-13-11(2-1-3-12(13)15(19)20)8-9-4-6-10(7-5-9)14(17)18/h1-7H,8,16H2,(H,17,18)(H,19,20)