[2-[4-(acetamidomethyl)phenyl]-2-oxidanylidene-ethyl] (2S)-2-benzamidopropanoate

Systemtic Name: [2-[4-(acetamidomethyl)phenyl]-2-oxidanylidene-ethyl] (2S)-2-benzamidopropanoate Openeye Name: [2-[4-(acetamidomethyl)phenyl]-2-oxo-ethyl] (2S)-2-benzamidopropanoate CAS Name: (2S)-2-benzamidopropanoic acid [2-[4-(acetamidomethyl)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(acetamidomethyl)phenyl]-2-oxoethyl] (2S)-2-benzamidopropanoate Traditional Name: (2S)-2-benzamidopropionic acid [2-[4-(acetamidomethyl)phenyl]-2-keto-ethyl] ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)C1=CC=C(C=C1)CNC(=O)C)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)C1=CC=C(C=C1)CNC(=O)C)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H22N2O5/c1-14(23-20(26)18-6-4-3-5-7-18)21(27)28-13-19(25)17-10-8-16(9-11-17)12-22-15(2)24/h3-11,14H,12-13H2,1-2H3,(H,22,24)(H,23,26)/t14-/m0/s1