[1]benzothiepino[5,4-c]pyridazine-10-carboxylate

Systemtic Name: [1]benzothiepino[5,4-c]pyridazine-10-carboxylate Openeye Name: [1]benzothiepino[5,4-c]pyridazine-10-carboxylate CAS Name: [1]benzothiepino[5,4-c]pyridazine-10-carboxylate IUPAC Name: [1]benzothiepino[5,4-c]pyridazine-10-carboxylate Traditional Name: [1]benzothiepino[5,4-c]pyridazine-10-carboxylate Formula: C13H7N2O2S- MolecularWeight: 255.27188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)[O-])C3=C(C=CN=N3)C=CS2

Isomeric SMILES

C1=CC2=C(C=C1C(=O)[O-])C3=C(C=CN=N3)C=CS2

InChI

InChI=1S/C13H8N2O2S/c16-13(17)9-1-2-11-10(7-9)12-8(4-6-18-11)3-5-14-15-12/h1-7H,(H,16,17)/p-1