[(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] (2S)-2-benzamidopropanoate

Systemtic Name: [(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] (2S)-2-benzamidopropanoate Openeye Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] (2S)-2-benzamidopropanoate CAS Name: (2S)-2-benzamidopropanoic acid [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] (2S)-2-benzamidopropanoate Traditional Name: (2S)-2-benzamidopropionic acid [(1R)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C1=CC=CC=C1)C(=O)NC2CC2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)O[C@H](C1=CC=CC=C1)C(=O)NC2CC2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4/c1-14(22-19(24)16-10-6-3-7-11-16)21(26)27-18(15-8-4-2-5-9-15)20(25)23-17-12-13-17/h2-11,14,17-18H,12-13H2,1H3,(H,22,24)(H,23,25)/t14-,18+/m0/s1