4-chloranyl-N-[2-(cyanomethyl)-4-methoxy-phenyl]butanamide

Systemtic Name: 4-chloranyl-N-[2-(cyanomethyl)-4-methoxy-phenyl]butanamide Openeye Name: 4-chloro-N-[2-(cyanomethyl)-4-methoxy-phenyl]butanamide CAS Name: 4-chloro-N-[2-(cyanomethyl)-4-methoxyphenyl]butanamide IUPAC Name: 4-chloro-N-[2-(cyanomethyl)-4-methoxyphenyl]butanamide Traditional Name: 4-chloro-N-[2-(cyanomethyl)-4-methoxy-phenyl]butyramide Formula: C13H15ClN2O2 MolecularWeight: 266.7234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CCCCl)CC#N

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CCCCl)CC#N

InChI

InChI=1S/C13H15ClN2O2/c1-18-11-4-5-12(10(9-11)6-8-15)16-13(17)3-2-7-14/h4-5,9H,2-3,6-7H2,1H3,(H,16,17)