benzo[b][1]benzoxepine; ethanedioate

Systemtic Name: benzo[b][1]benzoxepine; ethanedioate Openeye Name: benzo[b][1]benzoxepine; oxalate CAS Name: benzo[b][1]benzoxepin; oxalate IUPAC Name: benzo[b][1]benzoxepine; oxalate Traditional Name: benzo[b][1]benzoxepin; oxalate Formula: C16H10O5-2 MolecularWeight: 282.2476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=CC=CC=C3O2.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=CC=CC=C3O2.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C14H10O.C2H2O4/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)15-13;3-1(4)2(5)6/h1-10H;(H,3,4)(H,5,6)/p-2