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

Systemtic Name: 6-(3-oxidanylidene-4,4a,5,6-tetrahydrothieno[2,3-h]cinnolin-2-yl)hexanoic acid Openeye Name: 6-(3-oxo-4,4a,5,6-tetrahydrothieno[2,3-h]cinnolin-2-yl)hexanoic acid CAS Name: 6-(3-oxo-4,4a,5,6-tetrahydrothieno[2,3-h]cinnolin-2-yl)hexanoic acid IUPAC Name: 6-(3-oxo-4,4a,5,6-tetrahydrothieno[2,3-h]cinnolin-2-yl)hexanoic acid Traditional Name: 6-(3-keto-4,4a,5,6-tetrahydrothieno[2,3-h]cinnolin-2-yl)hexanoic acid Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O3S/c19-14-10-11-5-6-13-12(7-9-22-13)16(11)17-18(14)8-3-1-2-4-15(20)21/h7,9,11H,1-6,8,10H2,(H,20,21)