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

Systemtic Name: 3-ethanoyl-N-(3-methyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Openeye Name: 3-acetyl-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide CAS Name: 3-acetyl-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide IUPAC Name: 3-acetyl-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Traditional Name: 3-acetyl-N-(6-keto-3-methyl-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Formula: C22H18N2O5S MolecularWeight: 422.45372

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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=CC(=C4)C(=O)C)C(=O)N2

Isomeric SMILES

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

InChI

InChI=1S/C22H18N2O5S/c1-13-6-8-21-19(10-13)23-22(26)18-12-16(7-9-20(18)29-21)24-30(27,28)17-5-3-4-15(11-17)14(2)25/h3-12,24H,1-2H3,(H,23,26)