3-[(2-azanyl-3-phenyl-propanoyl)amino]benzoic acid

Systemtic Name: 3-[(2-azanyl-3-phenyl-propanoyl)amino]benzoic acid Openeye Name: 3-[(2-amino-3-phenyl-propanoyl)amino]benzoic acid CAS Name: 3-[(2-amino-1-oxo-3-phenylpropyl)amino]benzoic acid IUPAC Name: 3-[(2-amino-3-phenylpropanoyl)amino]benzoic acid Traditional Name: 3-(phenylalanylamino)benzoic acid Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=CC=CC(=C2)C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC2=CC=CC(=C2)C(=O)O)N

InChI

InChI=1S/C16H16N2O3/c17-14(9-11-5-2-1-3-6-11)15(19)18-13-8-4-7-12(10-13)16(20)21/h1-8,10,14H,9,17H2,(H,18,19)(H,20,21)