3-(3-oxidanylidene-4,4a,5,6-tetrahydrothieno[2,3-h]cinnolin-2-yl)propanoic acid

Systemtic Name: 3-(3-oxidanylidene-4,4a,5,6-tetrahydrothieno[2,3-h]cinnolin-2-yl)propanoic acid Openeye Name: 3-(3-oxo-4,4a,5,6-tetrahydrothieno[2,3-h]cinnolin-2-yl)propanoic acid CAS Name: 3-(3-oxo-4,4a,5,6-tetrahydrothieno[2,3-h]cinnolin-2-yl)propanoic acid IUPAC Name: 3-(3-oxo-4,4a,5,6-tetrahydrothieno[2,3-h]cinnolin-2-yl)propanoic acid Traditional Name: 3-(3-keto-4,4a,5,6-tetrahydrothieno[2,3-h]cinnolin-2-yl)propionic acid Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CS2)C3=NN(C(=O)CC31)CCC(=O)O

Isomeric SMILES

C1CC2=C(C=CS2)C3=NN(C(=O)CC31)CCC(=O)O

InChI

InChI=1S/C13H14N2O3S/c16-11-7-8-1-2-10-9(4-6-19-10)13(8)14-15(11)5-3-12(17)18/h4,6,8H,1-3,5,7H2,(H,17,18)