cyanomethyl 2-[(4-chlorophenyl)carbonylamino]-4-methyl-pentanoate

Systemtic Name: cyanomethyl 2-[(4-chlorophenyl)carbonylamino]-4-methyl-pentanoate Openeye Name: cyanomethyl 2-[(4-chlorobenzoyl)amino]-4-methyl-pentanoate CAS Name: 2-[[(4-chlorophenyl)-oxomethyl]amino]-4-methylpentanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-[(4-chlorobenzoyl)amino]-4-methylpentanoate Traditional Name: 2-[(4-chlorobenzoyl)amino]-4-methyl-valeric acid cyanomethyl ester Formula: C15H17ClN2O3 MolecularWeight: 308.76008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17ClN2O3/c1-10(2)9-13(15(20)21-8-7-17)18-14(19)11-3-5-12(16)6-4-11/h3-6,10,13H,8-9H2,1-2H3,(H,18,19)