(11E)-11-[3-(phenylsulfonylamino)propylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate

Systemtic Name: (11E)-11-[3-(phenylsulfonylamino)propylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate Openeye Name: (11E)-11-[3-(benzenesulfonamido)propylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate CAS Name: (11E)-11-[3-(benzenesulfonamido)propylidene]-6H-benzo[c][1]benzoxepin-2-carboxylate IUPAC Name: (11E)-11-[3-(benzenesulfonamido)propylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate Traditional Name: (11E)-11-[3-(benzenesulfonamido)propylidene]-6H-benzo[c][1]benzoxepin-2-carboxylate Formula: C24H20NO5S- MolecularWeight: 434.4843

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=CCCNS(=O)(=O)C3=CC=CC=C3)C4=C(O1)C=CC(=C4)C(=O)[O-]

Isomeric SMILES

C1C2=CC=CC=C2/C(=C\CCNS(=O)(=O)C3=CC=CC=C3)/C4=C(O1)C=CC(=C4)C(=O)[O-]

InChI

InChI=1S/C24H21NO5S/c26-24(27)17-12-13-23-22(15-17)21(20-10-5-4-7-18(20)16-30-23)11-6-14-25-31(28,29)19-8-2-1-3-9-19/h1-5,7-13,15,25H,6,14,16H2,(H,26,27)/p-1/b21-11+