1-(4-isocyano-4-methyl-cyclohexyl)ethylsulfonylbenzene

Systemtic Name: 1-(4-isocyano-4-methyl-cyclohexyl)ethylsulfonylbenzene Openeye Name: 1-(4-isocyano-4-methyl-cyclohexyl)ethylsulfonylbenzene CAS Name: 1-(4-isocyano-4-methylcyclohexyl)ethylsulfonylbenzene IUPAC Name: 1-(4-isocyano-4-methylcyclohexyl)ethylsulfonylbenzene Traditional Name: 1-(4-isocyano-4-methyl-cyclohexyl)ethylsulfonylbenzene Formula: C16H21NO2S MolecularWeight: 291.40844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCC(CC1)(C)[N+]#[C-])S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C1CCC(CC1)(C)[N+]#[C-])S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H21NO2S/c1-13(14-9-11-16(2,17-3)12-10-14)20(18,19)15-7-5-4-6-8-15/h4-8,13-14H,9-12H2,1-2H3