propan-2-yl 4-chloranyl-2-cyano-cyclohexa-1,3-diene-1-carboxylate

Systemtic Name: propan-2-yl 4-chloranyl-2-cyano-cyclohexa-1,3-diene-1-carboxylate Openeye Name: isopropyl 4-chloro-2-cyano-cyclohexa-1,3-diene-1-carboxylate CAS Name: 4-chloro-2-cyano-1-cyclohexa-1,3-dienecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-chloro-2-cyanocyclohexa-1,3-diene-1-carboxylate Traditional Name: 4-chloro-2-cyano-cyclohexa-1,3-diene-1-carboxylic acid isopropyl ester Formula: C11H12ClNO2 MolecularWeight: 225.67148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(C=C(CC1)Cl)C#N

Isomeric SMILES

CC(C)OC(=O)C1=C(C=C(CC1)Cl)C#N

InChI

InChI=1S/C11H12ClNO2/c1-7(2)15-11(14)10-4-3-9(12)5-8(10)6-13/h5,7H,3-4H2,1-2H3