5,5-dimethyl-4-[(4-methylphenyl)sulfonylmethyl]-N-phenyl-cyclohexene-1-carboxamide

Systemtic Name: 5,5-dimethyl-4-[(4-methylphenyl)sulfonylmethyl]-N-phenyl-cyclohexene-1-carboxamide Openeye Name: 5,5-dimethyl-N-phenyl-4-(p-tolylsulfonylmethyl)cyclohexene-1-carboxamide CAS Name: 5,5-dimethyl-4-[(4-methylphenyl)sulfonylmethyl]-N-phenyl-1-cyclohexenecarboxamide IUPAC Name: 5,5-dimethyl-4-[(4-methylphenyl)sulfonylmethyl]-N-phenylcyclohexene-1-carboxamide Traditional Name: 5,5-dimethyl-N-phenyl-4-(tosylmethyl)cyclohexene-1-carboxamide Formula: C23H27NO3S MolecularWeight: 397.53038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2CC=C(CC2(C)C)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2CC=C(CC2(C)C)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H27NO3S/c1-17-9-13-21(14-10-17)28(26,27)16-19-12-11-18(15-23(19,2)3)22(25)24-20-7-5-4-6-8-20/h4-11,13-14,19H,12,15-16H2,1-3H3,(H,24,25)