2-(4-chlorophenyl)sulfonyl-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone

Systemtic Name: 2-(4-chlorophenyl)sulfonyl-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone Openeye Name: 2-(4-chlorophenyl)sulfonyl-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone CAS Name: 2-(4-chlorophenyl)sulfonyl-1-[2-(1-methyl-2-pyrrolyl)-1-azepanyl]ethanone IUPAC Name: 2-(4-chlorophenyl)sulfonyl-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone Traditional Name: 2-(4-chlorophenyl)sulfonyl-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone Formula: C19H23ClN2O3S MolecularWeight: 394.91552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCCCCN2C(=O)CS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C=CC=C1C2CCCCCN2C(=O)CS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H23ClN2O3S/c1-21-12-5-7-17(21)18-6-3-2-4-13-22(18)19(23)14-26(24,25)16-10-8-15(20)9-11-16/h5,7-12,18H,2-4,6,13-14H2,1H3