5-(2-methylpropyl)-1-(5-oxidanylidene-1,2,4-triazinan-3-yl)pyrazole-3-carboxylic acid

Systemtic Name: 5-(2-methylpropyl)-1-(5-oxidanylidene-1,2,4-triazinan-3-yl)pyrazole-3-carboxylic acid Openeye Name: 5-isobutyl-1-(5-oxo-1,2,4-triazinan-3-yl)pyrazole-3-carboxylic acid CAS Name: 5-(2-methylpropyl)-1-(5-oxo-1,2,4-triazinan-3-yl)-3-pyrazolecarboxylic acid IUPAC Name: 5-(2-methylpropyl)-1-(5-oxo-1,2,4-triazinan-3-yl)pyrazole-3-carboxylic acid Traditional Name: 5-isobutyl-1-(5-keto-1,2,4-triazinan-3-yl)pyrazole-3-carboxylic acid Formula: C11H17N5O3 MolecularWeight: 267.28438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=NN1C2NC(=O)CNN2)C(=O)O

Isomeric SMILES

CC(C)CC1=CC(=NN1C2NC(=O)CNN2)C(=O)O

InChI

InChI=1S/C11H17N5O3/c1-6(2)3-7-4-8(10(18)19)15-16(7)11-13-9(17)5-12-14-11/h4,6,11-12,14H,3,5H2,1-2H3,(H,13,17)(H,18,19)