methyl (11E)-11-[2-(phenylsulfonylamino)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate

Systemtic Name: methyl (11E)-11-[2-(phenylsulfonylamino)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate Openeye Name: methyl (11E)-11-[2-(benzenesulfonamido)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate CAS Name: (11E)-11-[2-(benzenesulfonamido)ethylidene]-6H-benzo[c][1]benzoxepin-2-carboxylic acid methyl ester IUPAC Name: methyl (11E)-11-[2-(benzenesulfonamido)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate Traditional Name: (11E)-11-[2-(benzenesulfonamido)ethylidene]-6H-benzo[c][1]benzoxepin-2-carboxylic acid methyl ester Formula: C24H21NO5S MolecularWeight: 435.49224

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OCC3=CC=CC=C3C2=CCNS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC\2=C(C=C1)OCC3=CC=CC=C3/C2=C\CNS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H21NO5S/c1-29-24(26)17-11-12-23-22(15-17)21(20-10-6-5-7-18(20)16-30-23)13-14-25-31(27,28)19-8-3-2-4-9-19/h2-13,15,25H,14,16H2,1H3/b21-13+