[1]benzothiepino[5,4-c]pyridazine-10-carboxylic acid

Systemtic Name: [1]benzothiepino[5,4-c]pyridazine-10-carboxylic acid Openeye Name: [1]benzothiepino[5,4-c]pyridazine-10-carboxylic acid CAS Name: [1]benzothiepino[5,4-c]pyridazine-10-carboxylic acid IUPAC Name: [1]benzothiepino[5,4-c]pyridazine-10-carboxylic acid Traditional Name: [1]benzothiepino[5,4-c]pyridazine-10-carboxylic acid Formula: C13H8N2O2S MolecularWeight: 256.27982

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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)