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

Systemtic Name: [1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 3-benzamidobutanoate Openeye Name: [2-(cycloheptylamino)-1-methyl-2-oxo-ethyl] 3-benzamidobutanoate CAS Name: 3-benzamidobutanoic acid [1-(cycloheptylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cycloheptylamino)-1-oxopropan-2-yl] 3-benzamidobutanoate Traditional Name: 3-benzamidobutyric acid [2-(cycloheptylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC(C)C(=O)NC1CCCCCC1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(CC(=O)OC(C)C(=O)NC1CCCCCC1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H30N2O4/c1-15(22-21(26)17-10-6-5-7-11-17)14-19(24)27-16(2)20(25)23-18-12-8-3-4-9-13-18/h5-7,10-11,15-16,18H,3-4,8-9,12-14H2,1-2H3,(H,22,26)(H,23,25)