2-[[(1-oxidanylidene-3-phenyl-propan-2-yl)amino]methyl]benzoic acid

Systemtic Name: 2-[[(1-oxidanylidene-3-phenyl-propan-2-yl)amino]methyl]benzoic acid Openeye Name: 2-[[(1-benzyl-2-oxo-ethyl)amino]methyl]benzoic acid CAS Name: 2-[[(1-oxo-3-phenylpropan-2-yl)amino]methyl]benzoic acid IUPAC Name: 2-[[(1-oxo-3-phenylpropan-2-yl)amino]methyl]benzoic acid Traditional Name: 2-[[(1-benzyl-2-keto-ethyl)amino]methyl]benzoic acid Formula: C17H17NO3 MolecularWeight: 283.32178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C=O)NCC2=CC=CC=C2C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C=O)NCC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C17H17NO3/c19-12-15(10-13-6-2-1-3-7-13)18-11-14-8-4-5-9-16(14)17(20)21/h1-9,12,15,18H,10-11H2,(H,20,21)