methyl 4-(2-chloranyl-2,4-dicyano-butyl)benzoate

Systemtic Name: methyl 4-(2-chloranyl-2,4-dicyano-butyl)benzoate Openeye Name: methyl 4-(2-chloro-2,4-dicyano-butyl)benzoate CAS Name: 4-(2-chloro-2,4-dicyanobutyl)benzoic acid methyl ester IUPAC Name: methyl 4-(2-chloro-2,4-dicyanobutyl)benzoate Traditional Name: 4-(2-chloro-2,4-dicyano-butyl)benzoic acid methyl ester Formula: C14H13ClN2O2 MolecularWeight: 276.71822

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CC(CCC#N)(C#N)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CC(CCC#N)(C#N)Cl

InChI

InChI=1S/C14H13ClN2O2/c1-19-13(18)12-5-3-11(4-6-12)9-14(15,10-17)7-2-8-16/h3-6H,2,7,9H2,1H3