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

Systemtic Name: 2-chloranyl-4-methoxy-N-(3-methyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Openeye Name: 2-chloro-4-methoxy-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide CAS Name: 2-chloro-4-methoxy-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide IUPAC Name: 2-chloro-4-methoxy-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Traditional Name: 2-chloro-N-(6-keto-3-methyl-5H-benzo[b][1,4]benzoxazepin-8-yl)-4-methoxy-benzenesulfonamide Formula: C21H17ClN2O5S MolecularWeight: 444.88808

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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=C(C=C(C=C4)OC)Cl)C(=O)N2

Isomeric SMILES

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

InChI

InChI=1S/C21H17ClN2O5S/c1-12-3-6-19-17(9-12)23-21(25)15-10-13(4-7-18(15)29-19)24-30(26,27)20-8-5-14(28-2)11-16(20)22/h3-11,24H,1-2H3,(H,23,25)