[(2S)-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl] 3-acetamidobenzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl] 3-acetamidobenzoate Openeye Name: [(1S)-1-(benzylcarbamoyl)propyl] 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [(2S)-1-oxo-1-[(phenylmethyl)amino]butan-2-yl] ester IUPAC Name: [(2S)-1-(benzylamino)-1-oxobutan-2-yl] 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid [(1S)-1-(benzylcarbamoyl)propyl] ester Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)OC(=O)C2=CC(=CC=C2)NC(=O)C

Isomeric SMILES

CC[C@@H](C(=O)NCC1=CC=CC=C1)OC(=O)C2=CC(=CC=C2)NC(=O)C

InChI

InChI=1S/C20H22N2O4/c1-3-18(19(24)21-13-15-8-5-4-6-9-15)26-20(25)16-10-7-11-17(12-16)22-14(2)23/h4-12,18H,3,13H2,1-2H3,(H,21,24)(H,22,23)/t18-/m0/s1