1,6-dimethyl-3-thiophen-2-yl-5,6,7,8-tetrahydropyrazolo[3,4-b]quinoline-4-carboxylic acid

Systemtic Name: 1,6-dimethyl-3-thiophen-2-yl-5,6,7,8-tetrahydropyrazolo[3,4-b]quinoline-4-carboxylic acid Openeye Name: 1,6-dimethyl-3-(2-thienyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]quinoline-4-carboxylic acid CAS Name: 1,6-dimethyl-3-thiophen-2-yl-5,6,7,8-tetrahydropyrazolo[3,4-b]quinoline-4-carboxylic acid IUPAC Name: 1,6-dimethyl-3-thiophen-2-yl-5,6,7,8-tetrahydropyrazolo[3,4-b]quinoline-4-carboxylic acid Traditional Name: 1,6-dimethyl-3-(2-thienyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]quinoline-4-carboxylic acid Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=C3C(=NN(C3=N2)C)C4=CC=CS4)C(=O)O

Isomeric SMILES

CC1CCC2=C(C1)C(=C3C(=NN(C3=N2)C)C4=CC=CS4)C(=O)O

InChI

InChI=1S/C17H17N3O2S/c1-9-5-6-11-10(8-9)13(17(21)22)14-15(12-4-3-7-23-12)19-20(2)16(14)18-11/h3-4,7,9H,5-6,8H2,1-2H3,(H,21,22)