5-oxidanylidene-6H-benzo[b][1]benzothiepine-2-carboxylate

Systemtic Name: 5-oxidanylidene-6H-benzo[b][1]benzothiepine-2-carboxylate Openeye Name: 5-oxo-6H-benzo[b][1]benzothiepine-2-carboxylate CAS Name: 5-oxo-6H-benzo[b][1]benzothiepin-2-carboxylate IUPAC Name: 5-oxo-6H-benzo[b][1]benzothiepine-2-carboxylate Traditional Name: 5-keto-6H-benzo[b][1]benzothiepin-2-carboxylate Formula: C15H9O3S- MolecularWeight: 269.29516

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2SC3=C(C1=O)C=CC(=C3)C(=O)[O-]

Isomeric SMILES

C1C2=CC=CC=C2SC3=C(C1=O)C=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C15H10O3S/c16-12-7-9-3-1-2-4-13(9)19-14-8-10(15(17)18)5-6-11(12)14/h1-6,8H,7H2,(H,17,18)/p-1