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

Systemtic Name: N-(3-chloranyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)-3-ethanoyl-benzenesulfonamide Openeye Name: 3-acetyl-N-(3-chloro-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide CAS Name: 3-acetyl-N-(3-chloro-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide IUPAC Name: 3-acetyl-N-(3-chloro-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Traditional Name: 3-acetyl-N-(3-chloro-6-keto-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Formula: C21H15ClN2O5S MolecularWeight: 442.8722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15ClN2O5S/c1-12(25)13-3-2-4-16(9-13)30(27,28)24-15-6-8-19-17(11-15)21(26)23-18-10-14(22)5-7-20(18)29-19/h2-11,24H,1H3,(H,23,26)