N-(3,3-dimethyl-4-oxidanylidene-2,5-dihydro-1,5-benzoxazepin-7-yl)-4-ethoxy-3,5-dimethyl-benzenesulfonamide

Systemtic Name: N-(3,3-dimethyl-4-oxidanylidene-2,5-dihydro-1,5-benzoxazepin-7-yl)-4-ethoxy-3,5-dimethyl-benzenesulfonamide Openeye Name: N-(3,3-dimethyl-4-oxo-2,5-dihydro-1,5-benzoxazepin-7-yl)-4-ethoxy-3,5-dimethyl-benzenesulfonamide CAS Name: N-(3,3-dimethyl-4-oxo-2,5-dihydro-1,5-benzoxazepin-7-yl)-4-ethoxy-3,5-dimethylbenzenesulfonamide IUPAC Name: N-(3,3-dimethyl-4-oxo-2,5-dihydro-1,5-benzoxazepin-7-yl)-4-ethoxy-3,5-dimethylbenzenesulfonamide Traditional Name: 4-ethoxy-N-(4-keto-3,3-dimethyl-2,5-dihydro-1,5-benzoxazepin-7-yl)-3,5-dimethyl-benzenesulfonamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1C)S(=O)(=O)NC2=CC3=C(C=C2)OCC(C(=O)N3)(C)C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1C)S(=O)(=O)NC2=CC3=C(C=C2)OCC(C(=O)N3)(C)C)C

InChI

InChI=1S/C21H26N2O5S/c1-6-27-19-13(2)9-16(10-14(19)3)29(25,26)23-15-7-8-18-17(11-15)22-20(24)21(4,5)12-28-18/h7-11,23H,6,12H2,1-5H3,(H,22,24)