[2-(cyclopropylamino)-2-oxidanylidene-ethyl] (2R)-3-methyl-2-(phenylcarbamoylamino)butanoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] (2R)-3-methyl-2-(phenylcarbamoylamino)butanoate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] (2R)-3-methyl-2-(phenylcarbamoylamino)butanoate CAS Name: (2R)-2-[[anilino(oxo)methyl]amino]-3-methylbutanoic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] (2R)-3-methyl-2-(phenylcarbamoylamino)butanoate Traditional Name: (2R)-3-methyl-2-(phenylcarbamoylamino)butyric acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NC1CC1)NC(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@H](C(=O)OCC(=O)NC1CC1)NC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C17H23N3O4/c1-11(2)15(16(22)24-10-14(21)18-13-8-9-13)20-17(23)19-12-6-4-3-5-7-12/h3-7,11,13,15H,8-10H2,1-2H3,(H,18,21)(H2,19,20,23)/t15-/m1/s1