5-methyl-1-(4-oxidanylidene-5,6,7,8-tetrahydro-4aH-quinazolin-2-yl)pyrazole-3-carboxylic acid

Systemtic Name: 5-methyl-1-(4-oxidanylidene-5,6,7,8-tetrahydro-4aH-quinazolin-2-yl)pyrazole-3-carboxylic acid Openeye Name: 5-methyl-1-(4-oxo-5,6,7,8-tetrahydro-4aH-quinazolin-2-yl)pyrazole-3-carboxylic acid CAS Name: 5-methyl-1-(4-oxo-5,6,7,8-tetrahydro-4aH-quinazolin-2-yl)-3-pyrazolecarboxylic acid IUPAC Name: 5-methyl-1-(4-oxo-5,6,7,8-tetrahydro-4aH-quinazolin-2-yl)pyrazole-3-carboxylic acid Traditional Name: 1-(4-keto-5,6,7,8-tetrahydro-4aH-quinazolin-2-yl)-5-methyl-pyrazole-3-carboxylic acid Formula: C13H14N4O3 MolecularWeight: 274.27526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC(=O)C3CCCCC3=N2)C(=O)O

Isomeric SMILES

CC1=CC(=NN1C2=NC(=O)C3CCCCC3=N2)C(=O)O

InChI

InChI=1S/C13H14N4O3/c1-7-6-10(12(19)20)16-17(7)13-14-9-5-3-2-4-8(9)11(18)15-13/h6,8H,2-5H2,1H3,(H,19,20)