2,5-bis(chloranyl)-3,6-dimethyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzenesulfonamide

Systemtic Name: 2,5-bis(chloranyl)-3,6-dimethyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzenesulfonamide Openeye Name: 2,5-dichloro-3,6-dimethyl-N-[3-(2-oxoazepan-1-yl)propyl]benzenesulfonamide CAS Name: 2,5-dichloro-3,6-dimethyl-N-[3-(2-oxo-1-azepanyl)propyl]benzenesulfonamide IUPAC Name: 2,5-dichloro-3,6-dimethyl-N-[3-(2-oxoazepan-1-yl)propyl]benzenesulfonamide Traditional Name: 2,5-dichloro-N-[3-(2-ketoazepan-1-yl)propyl]-3,6-dimethyl-benzenesulfonamide Formula: C17H24Cl2N2O3S MolecularWeight: 407.35506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Cl)S(=O)(=O)NCCCN2CCCCCC2=O)C)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1Cl)S(=O)(=O)NCCCN2CCCCCC2=O)C)Cl

InChI

InChI=1S/C17H24Cl2N2O3S/c1-12-11-14(18)13(2)17(16(12)19)25(23,24)20-8-6-10-21-9-5-3-4-7-15(21)22/h11,20H,3-10H2,1-2H3