3-chloranyl-N-(3,5-dimethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-2-methyl-benzenesulfonamide

Systemtic Name: 3-chloranyl-N-(3,5-dimethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-2-methyl-benzenesulfonamide Openeye Name: 3-chloro-N-(3,5-dimethyl-6-oxo-benzo[b][1,4]benzoxazepin-8-yl)-2-methyl-benzenesulfonamide CAS Name: 3-chloro-N-(3,5-dimethyl-6-oxo-8-benzo[b][1,4]benzoxazepinyl)-2-methylbenzenesulfonamide IUPAC Name: 3-chloro-N-(3,5-dimethyl-6-oxobenzo[b][1,4]benzoxazepin-8-yl)-2-methylbenzenesulfonamide Traditional Name: 3-chloro-N-(6-keto-3,5-dimethyl-benzo[b][1,4]benzoxazepin-8-yl)-2-methyl-benzenesulfonamide Formula: C22H19ClN2O4S MolecularWeight: 442.91526

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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=C(C(=CC=C4)Cl)C)C(=O)N2C

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NS(=O)(=O)C4=C(C(=CC=C4)Cl)C)C(=O)N2C

InChI

InChI=1S/C22H19ClN2O4S/c1-13-7-9-20-18(11-13)25(3)22(26)16-12-15(8-10-19(16)29-20)24-30(27,28)21-6-4-5-17(23)14(21)2/h4-12,24H,1-3H3