N-(3-ethyl-5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-2,4,5-trimethyl-benzenesulfonamide

Systemtic Name: N-(3-ethyl-5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-2,4,5-trimethyl-benzenesulfonamide Openeye Name: N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-2,4,5-trimethyl-benzenesulfonamide CAS Name: N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-2,4,5-trimethylbenzenesulfonamide IUPAC Name: N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-2,4,5-trimethylbenzenesulfonamide Traditional Name: N-(3-ethyl-5-keto-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-2,4,5-trimethyl-benzenesulfonamide Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CCC1COC2=C(C=C(C=C2)NS(=O)(=O)C3=C(C=C(C(=C3)C)C)C)C(=O)N1

Isomeric SMILES

CCC1COC2=C(C=C(C=C2)NS(=O)(=O)C3=C(C=C(C(=C3)C)C)C)C(=O)N1

InChI

InChI=1S/C20H24N2O4S/c1-5-15-11-26-18-7-6-16(10-17(18)20(23)21-15)22-27(24,25)19-9-13(3)12(2)8-14(19)4/h6-10,15,22H,5,11H2,1-4H3,(H,21,23)