(11E)-11-[2-(3-oxidanylidene-2H-indazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate

Systemtic Name: (11E)-11-[2-(3-oxidanylidene-2H-indazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate Openeye Name: (11E)-11-[2-(3-oxo-2H-indazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate CAS Name: (11E)-11-[2-(3-oxo-2H-indazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepin-2-carboxylate IUPAC Name: (11E)-11-[2-(3-oxo-2H-indazol-1-yl)ethylidene]-6H-benzo[c][1]benzoxepine-2-carboxylate Traditional Name: (11E)-11-[2-(3-ketoindazolin-1-yl)ethylidene]-6H-benzo[c][1]benzoxepin-2-carboxylate Formula: C24H17N2O4- MolecularWeight: 397.40278

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=CCN3C4=CC=CC=C4C(=O)N3)C5=C(O1)C=CC(=C5)C(=O)[O-]

Isomeric SMILES

C1C2=CC=CC=C2/C(=C\CN3C4=CC=CC=C4C(=O)N3)/C5=C(O1)C=CC(=C5)C(=O)[O-]

InChI

InChI=1S/C24H18N2O4/c27-23-19-7-3-4-8-21(19)26(25-23)12-11-18-17-6-2-1-5-16(17)14-30-22-10-9-15(24(28)29)13-20(18)22/h1-11,13H,12,14H2,(H,25,27)(H,28,29)/p-1/b18-11+