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

Systemtic Name: 5-ethyl-1-(4-oxidanylidene-5,6,7,8-tetrahydro-4aH-quinazolin-2-yl)pyrazole-3-carboxylic acid Openeye Name: 5-ethyl-1-(4-oxo-5,6,7,8-tetrahydro-4aH-quinazolin-2-yl)pyrazole-3-carboxylic acid CAS Name: 5-ethyl-1-(4-oxo-5,6,7,8-tetrahydro-4aH-quinazolin-2-yl)-3-pyrazolecarboxylic acid IUPAC Name: 5-ethyl-1-(4-oxo-5,6,7,8-tetrahydro-4aH-quinazolin-2-yl)pyrazole-3-carboxylic acid Traditional Name: 5-ethyl-1-(4-keto-5,6,7,8-tetrahydro-4aH-quinazolin-2-yl)pyrazole-3-carboxylic acid Formula: C14H16N4O3 MolecularWeight: 288.30184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NN1C2=NC(=O)C3CCCCC3=N2)C(=O)O

Isomeric SMILES

CCC1=CC(=NN1C2=NC(=O)C3CCCCC3=N2)C(=O)O

InChI

InChI=1S/C14H16N4O3/c1-2-8-7-11(13(20)21)17-18(8)14-15-10-6-4-3-5-9(10)12(19)16-14/h7,9H,2-6H2,1H3,(H,20,21)