[(1S)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 3-(phenylcarbamoylamino)propanoate

Systemtic Name: [(1S)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 3-(phenylcarbamoylamino)propanoate Openeye Name: [(1S)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 3-(phenylcarbamoylamino)propanoate CAS Name: 3-[[anilino(oxo)methyl]amino]propanoic acid [(1S)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] 3-(phenylcarbamoylamino)propanoate Traditional Name: 3-(phenylcarbamoylamino)propionic acid [(1S)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(C2=CC=CC=C2)OC(=O)CCNC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CC1NC(=O)[C@H](C2=CC=CC=C2)OC(=O)CCNC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O4/c25-18(13-14-22-21(27)24-16-9-5-2-6-10-16)28-19(15-7-3-1-4-8-15)20(26)23-17-11-12-17/h1-10,17,19H,11-14H2,(H,23,26)(H2,22,24,27)/t19-/m0/s1