[2-[(2-cyano-3-methyl-butan-2-yl)amino]-2-oxidanylidene-ethyl] 3-acetamido-3-(2-chlorophenyl)propanoate

Systemtic Name: [2-[(2-cyano-3-methyl-butan-2-yl)amino]-2-oxidanylidene-ethyl] 3-acetamido-3-(2-chlorophenyl)propanoate Openeye Name: [2-[(1-cyano-1,2-dimethyl-propyl)amino]-2-oxo-ethyl] 3-acetamido-3-(2-chlorophenyl)propanoate CAS Name: 3-acetamido-3-(2-chlorophenyl)propanoic acid [2-[(2-cyano-3-methylbutan-2-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-cyano-3-methylbutan-2-yl)amino]-2-oxoethyl] 3-acetamido-3-(2-chlorophenyl)propanoate Traditional Name: 3-acetamido-3-(2-chlorophenyl)propionic acid [2-[(1-cyano-1,2-dimethyl-propyl)amino]-2-keto-ethyl] ester Formula: C19H24ClN3O4 MolecularWeight: 393.86456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)COC(=O)CC(C1=CC=CC=C1Cl)NC(=O)C

Isomeric SMILES

CC(C)C(C)(C#N)NC(=O)COC(=O)CC(C1=CC=CC=C1Cl)NC(=O)C

InChI

InChI=1S/C19H24ClN3O4/c1-12(2)19(4,11-21)23-17(25)10-27-18(26)9-16(22-13(3)24)14-7-5-6-8-15(14)20/h5-8,12,16H,9-10H2,1-4H3,(H,22,24)(H,23,25)