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

Systemtic Name: 5-(3-oxidanylidene-4,4a,5,6-tetrahydrothieno[2,3-h]cinnolin-2-yl)pentanoic acid Openeye Name: 5-(3-oxo-4,4a,5,6-tetrahydrothieno[2,3-h]cinnolin-2-yl)pentanoic acid CAS Name: 5-(3-oxo-4,4a,5,6-tetrahydrothieno[2,3-h]cinnolin-2-yl)pentanoic acid IUPAC Name: 5-(3-oxo-4,4a,5,6-tetrahydrothieno[2,3-h]cinnolin-2-yl)pentanoic acid Traditional Name: 5-(3-keto-4,4a,5,6-tetrahydrothieno[2,3-h]cinnolin-2-yl)valeric acid Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O3S/c18-13-9-10-4-5-12-11(6-8-21-12)15(10)16-17(13)7-2-1-3-14(19)20/h6,8,10H,1-5,7,9H2,(H,19,20)