4-chloranyl-N-(3-methylbutyl)-N-[(3R)-2-oxidanylideneazepan-3-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(3-methylbutyl)-N-[(3R)-2-oxidanylideneazepan-3-yl]benzenesulfonamide Openeye Name: 4-chloro-N-isopentyl-N-[(3R)-2-oxoazepan-3-yl]benzenesulfonamide CAS Name: 4-chloro-N-(3-methylbutyl)-N-[(3R)-2-oxo-3-azepanyl]benzenesulfonamide IUPAC Name: 4-chloro-N-(3-methylbutyl)-N-[(3R)-2-oxoazepan-3-yl]benzenesulfonamide Traditional Name: 4-chloro-N-isoamyl-N-[(3R)-2-ketoazepan-3-yl]benzenesulfonamide Formula: C17H25ClN2O3S MolecularWeight: 372.91

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(C1CCCCNC1=O)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)CCN([C@@H]1CCCCNC1=O)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H25ClN2O3S/c1-13(2)10-12-20(16-5-3-4-11-19-17(16)21)24(22,23)15-8-6-14(18)7-9-15/h6-9,13,16H,3-5,10-12H2,1-2H3,(H,19,21)/t16-/m1/s1