[1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 3-benzamidobutanoate

Systemtic Name: [1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 3-benzamidobutanoate Openeye Name: [2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 3-benzamidobutanoate CAS Name: 3-benzamidobutanoic acid [1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclopropylamino)-1-oxopropan-2-yl] 3-benzamidobutanoate Traditional Name: 3-benzamidobutyric acid [2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC(C)C(=O)NC1CC1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(CC(=O)OC(C)C(=O)NC1CC1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H22N2O4/c1-11(18-17(22)13-6-4-3-5-7-13)10-15(20)23-12(2)16(21)19-14-8-9-14/h3-7,11-12,14H,8-10H2,1-2H3,(H,18,22)(H,19,21)