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

Systemtic Name: 1-(3,4-dimethoxyphenyl)-N-(3-methyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)methanesulfonamide Openeye Name: 1-(3,4-dimethoxyphenyl)-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)methanesulfonamide CAS Name: 1-(3,4-dimethoxyphenyl)-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)methanesulfonamide IUPAC Name: 1-(3,4-dimethoxyphenyl)-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)methanesulfonamide Traditional Name: 1-(3,4-dimethoxyphenyl)-N-(6-keto-3-methyl-5H-benzo[b][1,4]benzoxazepin-8-yl)methanesulfonamide Formula: C23H22N2O6S MolecularWeight: 454.49558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NS(=O)(=O)CC4=CC(=C(C=C4)OC)OC)C(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NS(=O)(=O)CC4=CC(=C(C=C4)OC)OC)C(=O)N2

InChI

InChI=1S/C23H22N2O6S/c1-14-4-7-20-18(10-14)24-23(26)17-12-16(6-9-19(17)31-20)25-32(27,28)13-15-5-8-21(29-2)22(11-15)30-3/h4-12,25H,13H2,1-3H3,(H,24,26)