5-(4-oxidanylidene-3H-phthalazin-1-yl)thiophene-2-carboxylic acid

Systemtic Name: 5-(4-oxidanylidene-3H-phthalazin-1-yl)thiophene-2-carboxylic acid Openeye Name: 5-(4-oxo-3H-phthalazin-1-yl)thiophene-2-carboxylic acid CAS Name: 5-(4-oxo-3H-phthalazin-1-yl)-2-thiophenecarboxylic acid IUPAC Name: 5-(4-oxo-3H-phthalazin-1-yl)thiophene-2-carboxylic acid Traditional Name: 5-(4-keto-3H-phthalazin-1-yl)-2-thenoic acid Formula: C13H8N2O3S MolecularWeight: 272.27922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C3=CC=C(S3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C3=CC=C(S3)C(=O)O

InChI

InChI=1S/C13H8N2O3S/c16-12-8-4-2-1-3-7(8)11(14-15-12)9-5-6-10(19-9)13(17)18/h1-6H,(H,15,16)(H,17,18)