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

Systemtic Name: 4-tert-butyl-N-(3-chloranyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Openeye Name: 4-tert-butyl-N-(3-chloro-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide CAS Name: 4-tert-butyl-N-(3-chloro-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide IUPAC Name: 4-tert-butyl-N-(3-chloro-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Traditional Name: 4-tert-butyl-N-(3-chloro-6-keto-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Formula: C23H21ClN2O4S MolecularWeight: 456.94184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC4=C(C=C(C=C4)Cl)NC3=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC4=C(C=C(C=C4)Cl)NC3=O

InChI

InChI=1S/C23H21ClN2O4S/c1-23(2,3)14-4-8-17(9-5-14)31(28,29)26-16-7-11-20-18(13-16)22(27)25-19-12-15(24)6-10-21(19)30-20/h4-13,26H,1-3H3,(H,25,27)