3-(azepan-1-ylsulfonyl)benzenesulfonyl chloride

Systemtic Name: 3-(azepan-1-ylsulfonyl)benzenesulfonyl chloride Openeye Name: 3-(azepan-1-ylsulfonyl)benzenesulfonyl chloride CAS Name: 3-(1-azepanylsulfonyl)benzenesulfonyl chloride IUPAC Name: 3-(azepan-1-ylsulfonyl)benzenesulfonyl chloride Traditional Name: 3-(azepan-1-ylsulfonyl)benzenesulfonyl chloride Formula: C12H16ClNO4S2 MolecularWeight: 337.84274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)Cl

InChI

InChI=1S/C12H16ClNO4S2/c13-19(15,16)11-6-5-7-12(10-11)20(17,18)14-8-3-1-2-4-9-14/h5-7,10H,1-4,8-9H2