N-(3,3-dimethyl-4-oxidanylidene-2,5-dihydro-1,5-benzoxazepin-8-yl)-4-ethoxy-3-fluoranyl-benzenesulfonamide

Systemtic Name: N-(3,3-dimethyl-4-oxidanylidene-2,5-dihydro-1,5-benzoxazepin-8-yl)-4-ethoxy-3-fluoranyl-benzenesulfonamide Openeye Name: N-(3,3-dimethyl-4-oxo-2,5-dihydro-1,5-benzoxazepin-8-yl)-4-ethoxy-3-fluoro-benzenesulfonamide CAS Name: N-(3,3-dimethyl-4-oxo-2,5-dihydro-1,5-benzoxazepin-8-yl)-4-ethoxy-3-fluorobenzenesulfonamide IUPAC Name: N-(3,3-dimethyl-4-oxo-2,5-dihydro-1,5-benzoxazepin-8-yl)-4-ethoxy-3-fluorobenzenesulfonamide Traditional Name: 4-ethoxy-3-fluoro-N-(4-keto-3,3-dimethyl-2,5-dihydro-1,5-benzoxazepin-8-yl)benzenesulfonamide Formula: C19H21FN2O5S MolecularWeight: 408.443843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)NC(=O)C(CO3)(C)C)F

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)NC(=O)C(CO3)(C)C)F

InChI

InChI=1S/C19H21FN2O5S/c1-4-26-16-8-6-13(10-14(16)20)28(24,25)22-12-5-7-15-17(9-12)27-11-19(2,3)18(23)21-15/h5-10,22H,4,11H2,1-3H3,(H,21,23)