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

Systemtic Name: 2-chloranyl-N-(5-ethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-4-methoxy-benzenesulfonamide Openeye Name: 2-chloro-N-(5-ethyl-6-oxo-benzo[b][1,4]benzoxazepin-8-yl)-4-methoxy-benzenesulfonamide CAS Name: 2-chloro-N-(5-ethyl-6-oxo-8-benzo[b][1,4]benzoxazepinyl)-4-methoxybenzenesulfonamide IUPAC Name: 2-chloro-N-(5-ethyl-6-oxobenzo[b][1,4]benzoxazepin-8-yl)-4-methoxybenzenesulfonamide Traditional Name: 2-chloro-N-(5-ethyl-6-keto-benzo[b][1,4]benzoxazepin-8-yl)-4-methoxy-benzenesulfonamide Formula: C22H19ClN2O5S MolecularWeight: 458.91466

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2OC3=C(C1=O)C=C(C=C3)NS(=O)(=O)C4=C(C=C(C=C4)OC)Cl

Isomeric SMILES

CCN1C2=CC=CC=C2OC3=C(C1=O)C=C(C=C3)NS(=O)(=O)C4=C(C=C(C=C4)OC)Cl

InChI

InChI=1S/C22H19ClN2O5S/c1-3-25-18-6-4-5-7-20(18)30-19-10-8-14(12-16(19)22(25)26)24-31(27,28)21-11-9-15(29-2)13-17(21)23/h4-13,24H,3H2,1-2H3