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

Systemtic Name: 1-(3,4-dimethoxyphenyl)-N-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl)methanesulfonamide Openeye Name: 1-(3,4-dimethoxyphenyl)-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)methanesulfonamide CAS Name: 1-(3,4-dimethoxyphenyl)-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)methanesulfonamide IUPAC Name: 1-(3,4-dimethoxyphenyl)-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)methanesulfonamide Traditional Name: 1-(3,4-dimethoxyphenyl)-N-(4-keto-3,3,5-trimethyl-2H-1,5-benzoxazepin-7-yl)methanesulfonamide Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=C(C=C2)NS(=O)(=O)CC3=CC(=C(C=C3)OC)OC)N(C1=O)C)C

Isomeric SMILES

CC1(COC2=C(C=C(C=C2)NS(=O)(=O)CC3=CC(=C(C=C3)OC)OC)N(C1=O)C)C

InChI

InChI=1S/C21H26N2O6S/c1-21(2)13-29-17-9-7-15(11-16(17)23(3)20(21)24)22-30(25,26)12-14-6-8-18(27-4)19(10-14)28-5/h6-11,22H,12-13H2,1-5H3