N-[4-[2-(2-methoxyphenyl)ethyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide

Systemtic Name: N-[4-[2-(2-methoxyphenyl)ethyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Openeye Name: N-[4-[2-(2-methoxyphenyl)ethyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide CAS Name: N-[4-[2-(2-methoxyphenyl)ethyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide IUPAC Name: N-[4-[2-(2-methoxyphenyl)ethyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Traditional Name: N-[3-keto-4-[2-(2-methoxyphenyl)ethyl]-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Formula: C24H24N2O5S MolecularWeight: 452.52276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCN2CC3=C(C=CC(=C3)NS(=O)(=O)C4=CC=CC=C4)OCC2=O

Isomeric SMILES

COC1=CC=CC=C1CCN2CC3=C(C=CC(=C3)NS(=O)(=O)C4=CC=CC=C4)OCC2=O

InChI

InChI=1S/C24H24N2O5S/c1-30-22-10-6-5-7-18(22)13-14-26-16-19-15-20(11-12-23(19)31-17-24(26)27)25-32(28,29)21-8-3-2-4-9-21/h2-12,15,25H,13-14,16-17H2,1H3