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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1COC2=C(C=C(C=C2)NS(=O)(=O)CC3=C(C=CC(=C3)C)C)C(=O)N1

Isomeric SMILES

CCC1COC2=C(C=C(C=C2)NS(=O)(=O)CC3=C(C=CC(=C3)C)C)C(=O)N1

InChI

InChI=1S/C20H24N2O4S/c1-4-16-11-26-19-8-7-17(10-18(19)20(23)21-16)22-27(24,25)12-15-9-13(2)5-6-14(15)3/h5-10,16,22H,4,11-12H2,1-3H3,(H,21,23)