1-[4-(2-methylphenyl)piperazin-1-yl]sulfonylazepane

Systemtic Name: 1-[4-(2-methylphenyl)piperazin-1-yl]sulfonylazepane Openeye Name: 1-[4-(o-tolyl)piperazin-1-yl]sulfonylazepane CAS Name: 1-[[4-(2-methylphenyl)-1-piperazinyl]sulfonyl]azepane IUPAC Name: 1-[4-(2-methylphenyl)piperazin-1-yl]sulfonylazepane Traditional Name: 1-[4-(o-tolyl)piperazino]sulfonylazepane Formula: C17H27N3O2S MolecularWeight: 337.48018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C17H27N3O2S/c1-16-8-4-5-9-17(16)18-12-14-20(15-13-18)23(21,22)19-10-6-2-3-7-11-19/h4-5,8-9H,2-3,6-7,10-15H2,1H3