N-(3-chloranyl-4-cyano-phenyl)-3-methyl-butanamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-3-methyl-butanamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-3-methyl-butanamide CAS Name: N-(3-chloro-4-cyanophenyl)-3-methylbutanamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-3-methylbutanamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-3-methyl-butyramide Formula: C12H13ClN2O MolecularWeight: 236.69742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClN2O/c1-8(2)5-12(16)15-10-4-3-9(7-14)11(13)6-10/h3-4,6,8H,5H2,1-2H3,(H,15,16)