[(1R)-1-cyanoethyl] (2R)-2-[(2,4-dichlorophenyl)carbonylamino]-4-methyl-pentanoate

Systemtic Name: [(1R)-1-cyanoethyl] (2R)-2-[(2,4-dichlorophenyl)carbonylamino]-4-methyl-pentanoate Openeye Name: [(1R)-1-cyanoethyl] (2R)-2-[(2,4-dichlorobenzoyl)amino]-4-methyl-pentanoate CAS Name: (2R)-2-[[(2,4-dichlorophenyl)-oxomethyl]amino]-4-methylpentanoic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] (2R)-2-[(2,4-dichlorobenzoyl)amino]-4-methylpentanoate Traditional Name: (2R)-2-[(2,4-dichlorobenzoyl)amino]-4-methyl-valeric acid [(1R)-1-cyanoethyl] ester Formula: C16H18Cl2N2O3 MolecularWeight: 357.23172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC(C)C#N)NC(=O)C1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

C[C@H](C#N)OC(=O)[C@@H](CC(C)C)NC(=O)C1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C16H18Cl2N2O3/c1-9(2)6-14(16(22)23-10(3)8-19)20-15(21)12-5-4-11(17)7-13(12)18/h4-5,7,9-10,14H,6H2,1-3H3,(H,20,21)/t10-,14-/m1/s1