N-[3-(azepan-1-ylcarbonyl)phenyl]-3,4-bis(chloranyl)benzenesulfonamide

Systemtic Name: N-[3-(azepan-1-ylcarbonyl)phenyl]-3,4-bis(chloranyl)benzenesulfonamide Openeye Name: N-[3-(azepane-1-carbonyl)phenyl]-3,4-dichloro-benzenesulfonamide CAS Name: N-[3-[1-azepanyl(oxo)methyl]phenyl]-3,4-dichlorobenzenesulfonamide IUPAC Name: N-[3-(azepane-1-carbonyl)phenyl]-3,4-dichlorobenzenesulfonamide Traditional Name: N-[3-(azepane-1-carbonyl)phenyl]-3,4-dichloro-benzenesulfonamide Formula: C19H20Cl2N2O3S MolecularWeight: 427.3447

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H20Cl2N2O3S/c20-17-9-8-16(13-18(17)21)27(25,26)22-15-7-5-6-14(12-15)19(24)23-10-3-1-2-4-11-23/h5-9,12-13,22H,1-4,10-11H2