N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-2-phenyl-ethanesulfonamide

Systemtic Name: N-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-2-phenyl-ethanesulfonamide Openeye Name: N-(5-methyl-6-oxo-benzo[b][1,4]benzoxazepin-8-yl)-2-phenyl-ethanesulfonamide CAS Name: N-(5-methyl-6-oxo-8-benzo[b][1,4]benzoxazepinyl)-2-phenylethanesulfonamide IUPAC Name: N-(5-methyl-6-oxobenzo[b][1,4]benzoxazepin-8-yl)-2-phenylethanesulfonamide Traditional Name: N-(6-keto-5-methyl-benzo[b][1,4]benzoxazepin-8-yl)-2-phenyl-ethanesulfonamide Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2OC3=C(C1=O)C=C(C=C3)NS(=O)(=O)CCC4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2OC3=C(C1=O)C=C(C=C3)NS(=O)(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C22H20N2O4S/c1-24-19-9-5-6-10-21(19)28-20-12-11-17(15-18(20)22(24)25)23-29(26,27)14-13-16-7-3-2-4-8-16/h2-12,15,23H,13-14H2,1H3