[4-cyano-3-(4-methylphenyl)cyclohex-2-en-1-yl] methanesulfonate

Systemtic Name: [4-cyano-3-(4-methylphenyl)cyclohex-2-en-1-yl] methanesulfonate Openeye Name: [4-cyano-3-(p-tolyl)cyclohex-2-en-1-yl] methanesulfonate CAS Name: methanesulfonic acid [4-cyano-3-(4-methylphenyl)-1-cyclohex-2-enyl] ester IUPAC Name: [4-cyano-3-(4-methylphenyl)cyclohex-2-en-1-yl] methanesulfonate Traditional Name: methanesulfonic acid [4-cyano-3-(p-tolyl)cyclohex-2-en-1-yl] ester Formula: C15H17NO3S MolecularWeight: 291.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(CCC2C#N)OS(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(CCC2C#N)OS(=O)(=O)C

InChI

InChI=1S/C15H17NO3S/c1-11-3-5-12(6-4-11)15-9-14(19-20(2,17)18)8-7-13(15)10-16/h3-6,9,13-14H,7-8H2,1-2H3