3-chloranyl-4-methyl-N-(3-methyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide

Systemtic Name: 3-chloranyl-4-methyl-N-(3-methyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Openeye Name: 3-chloro-4-methyl-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide CAS Name: 3-chloro-4-methyl-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide IUPAC Name: 3-chloro-4-methyl-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Traditional Name: 3-chloro-N-(6-keto-3-methyl-5H-benzo[b][1,4]benzoxazepin-8-yl)-4-methyl-benzenesulfonamide Formula: C21H17ClN2O4S MolecularWeight: 428.88868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NS(=O)(=O)C4=CC(=C(C=C4)C)Cl)C(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NS(=O)(=O)C4=CC(=C(C=C4)C)Cl)C(=O)N2

InChI

InChI=1S/C21H17ClN2O4S/c1-12-3-7-20-18(9-12)23-21(25)16-10-14(5-8-19(16)28-20)24-29(26,27)15-6-4-13(2)17(22)11-15/h3-11,24H,1-2H3,(H,23,25)