1-(3,4-dimethoxyphenyl)-N-(5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)methanesulfonamide

Systemtic Name: 1-(3,4-dimethoxyphenyl)-N-(5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)methanesulfonamide Openeye Name: 1-(3,4-dimethoxyphenyl)-N-(5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)methanesulfonamide CAS Name: 1-(3,4-dimethoxyphenyl)-N-(5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)methanesulfonamide IUPAC Name: 1-(3,4-dimethoxyphenyl)-N-(5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)methanesulfonamide Traditional Name: 1-(3,4-dimethoxyphenyl)-N-(5-keto-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)methanesulfonamide Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CS(=O)(=O)NC2=CC3=C(C=C2)OCCNC3=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CS(=O)(=O)NC2=CC3=C(C=C2)OCCNC3=O)OC

InChI

InChI=1S/C18H20N2O6S/c1-24-16-5-3-12(9-17(16)25-2)11-27(22,23)20-13-4-6-15-14(10-13)18(21)19-7-8-26-15/h3-6,9-10,20H,7-8,11H2,1-2H3,(H,19,21)