3-[4-methyl-4-(phenylsulfonyl)pentyl]-3-azabicyclo[2.2.1]heptane-5-carbonitrile

Systemtic Name: 3-[4-methyl-4-(phenylsulfonyl)pentyl]-3-azabicyclo[2.2.1]heptane-5-carbonitrile Openeye Name: 3-[4-(benzenesulfonyl)-4-methyl-pentyl]-3-azabicyclo[2.2.1]heptane-5-carbonitrile CAS Name: 3-[4-(benzenesulfonyl)-4-methylpentyl]-3-azabicyclo[2.2.1]heptane-5-carbonitrile IUPAC Name: 3-[4-(benzenesulfonyl)-4-methylpentyl]-3-azabicyclo[2.2.1]heptane-5-carbonitrile Traditional Name: 3-(4-besyl-4-methyl-pentyl)-3-azabicyclo[2.2.1]heptane-5-carbonitrile Formula: C19H26N2O2S MolecularWeight: 346.48694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCN1CC2CC(C1C2)C#N)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(CCCN1CC2CC(C1C2)C#N)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H26N2O2S/c1-19(2,24(22,23)17-7-4-3-5-8-17)9-6-10-21-14-15-11-16(13-20)18(21)12-15/h3-5,7-8,15-16,18H,6,9-12,14H2,1-2H3