4-chloranyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-3-(trifluoromethyl)benzenesulfonamide Openeye Name: 4-chloro-N-[3-(2-oxoazepan-1-yl)propyl]-3-(trifluoromethyl)benzenesulfonamide CAS Name: 4-chloro-N-[3-(2-oxo-1-azepanyl)propyl]-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: 4-chloro-N-[3-(2-oxoazepan-1-yl)propyl]-3-(trifluoromethyl)benzenesulfonamide Traditional Name: 4-chloro-N-[3-(2-ketoazepan-1-yl)propyl]-3-(trifluoromethyl)benzenesulfonamide Formula: C16H20ClF3N2O3S MolecularWeight: 412.85481

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNS(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNS(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C16H20ClF3N2O3S/c17-14-7-6-12(11-13(14)16(18,19)20)26(24,25)21-8-4-10-22-9-3-1-2-5-15(22)23/h6-7,11,21H,1-5,8-10H2