3-chloranyl-N-(4-cyclohexyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)benzenesulfonamide

Systemtic Name: 3-chloranyl-N-(4-cyclohexyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)benzenesulfonamide Openeye Name: 3-chloro-N-(4-cyclohexyl-3-oxo-5H-1,4-benzoxazepin-7-yl)benzenesulfonamide CAS Name: 3-chloro-N-(4-cyclohexyl-3-oxo-5H-1,4-benzoxazepin-7-yl)benzenesulfonamide IUPAC Name: 3-chloro-N-(4-cyclohexyl-3-oxo-5H-1,4-benzoxazepin-7-yl)benzenesulfonamide Traditional Name: 3-chloro-N-(4-cyclohexyl-3-keto-5H-1,4-benzoxazepin-7-yl)benzenesulfonamide Formula: C21H23ClN2O4S MolecularWeight: 434.93632

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC3=C(C=CC(=C3)NS(=O)(=O)C4=CC(=CC=C4)Cl)OCC2=O

Isomeric SMILES

C1CCC(CC1)N2CC3=C(C=CC(=C3)NS(=O)(=O)C4=CC(=CC=C4)Cl)OCC2=O

InChI

InChI=1S/C21H23ClN2O4S/c22-16-5-4-8-19(12-16)29(26,27)23-17-9-10-20-15(11-17)13-24(21(25)14-28-20)18-6-2-1-3-7-18/h4-5,8-12,18,23H,1-3,6-7,13-14H2