5-chloranyl-N-(3-ethyl-5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-2-methyl-benzenesulfonamide

Systemtic Name: 5-chloranyl-N-(3-ethyl-5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-2-methyl-benzenesulfonamide Openeye Name: 5-chloro-N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-2-methyl-benzenesulfonamide CAS Name: 5-chloro-N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-2-methylbenzenesulfonamide IUPAC Name: 5-chloro-N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-2-methylbenzenesulfonamide Traditional Name: 5-chloro-N-(3-ethyl-5-keto-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-2-methyl-benzenesulfonamide Formula: C18H19ClN2O4S MolecularWeight: 394.87246

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Descriptors Computed from Structure

Canonical SMILES:

CCC1COC2=C(C=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)Cl)C)C(=O)N1

Isomeric SMILES

CCC1COC2=C(C=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)Cl)C)C(=O)N1

InChI

InChI=1S/C18H19ClN2O4S/c1-3-13-10-25-16-7-6-14(9-15(16)18(22)20-13)21-26(23,24)17-8-12(19)5-4-11(17)2/h4-9,13,21H,3,10H2,1-2H3,(H,20,22)