[2-[(5-chloranyl-2-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 4-methylpentanoate

Systemtic Name: [2-[(5-chloranyl-2-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 4-methylpentanoate Openeye Name: [2-(5-chloro-2-cyano-anilino)-2-oxo-ethyl] 4-methylpentanoate CAS Name: 4-methylpentanoic acid [2-(5-chloro-2-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(5-chloro-2-cyanoanilino)-2-oxoethyl] 4-methylpentanoate Traditional Name: 4-methylvaleric acid [2-(5-chloro-2-cyano-anilino)-2-keto-ethyl] ester Formula: C15H17ClN2O3 MolecularWeight: 308.76008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)OCC(=O)NC1=C(C=CC(=C1)Cl)C#N

Isomeric SMILES

CC(C)CCC(=O)OCC(=O)NC1=C(C=CC(=C1)Cl)C#N

InChI

InChI=1S/C15H17ClN2O3/c1-10(2)3-6-15(20)21-9-14(19)18-13-7-12(16)5-4-11(13)8-17/h4-5,7,10H,3,6,9H2,1-2H3,(H,18,19)