(1R,6S)-4-methyl-6-(phenylsulfonyl)cyclohex-3-ene-1-carbonitrile

Systemtic Name: (1R,6S)-4-methyl-6-(phenylsulfonyl)cyclohex-3-ene-1-carbonitrile Openeye Name: (1R,6S)-6-(benzenesulfonyl)-4-methyl-cyclohex-3-ene-1-carbonitrile CAS Name: (1R,6S)-6-(benzenesulfonyl)-4-methyl-1-cyclohex-3-enecarbonitrile IUPAC Name: (1R,6S)-6-(benzenesulfonyl)-4-methylcyclohex-3-ene-1-carbonitrile Traditional Name: (1R,6S)-6-besyl-4-methyl-cyclohex-3-ene-1-carbonitrile Formula: C14H15NO2S MolecularWeight: 261.3394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C(C1)S(=O)(=O)C2=CC=CC=C2)C#N

Isomeric SMILES

CC1=CC[C@@H]([C@H](C1)S(=O)(=O)C2=CC=CC=C2)C#N

InChI

InChI=1S/C14H15NO2S/c1-11-7-8-12(10-15)14(9-11)18(16,17)13-5-3-2-4-6-13/h2-7,12,14H,8-9H2,1H3/t12-,14+/m1/s1