1-ethyl-3-(hexylcarbamoylamino)pyrazole-4-carboxylic acid

Systemtic Name: 1-ethyl-3-(hexylcarbamoylamino)pyrazole-4-carboxylic acid Openeye Name: 1-ethyl-3-(hexylcarbamoylamino)pyrazole-4-carboxylic acid CAS Name: 1-ethyl-3-[[(hexylamino)-oxomethyl]amino]-4-pyrazolecarboxylic acid IUPAC Name: 1-ethyl-3-(hexylcarbamoylamino)pyrazole-4-carboxylic acid Traditional Name: 1-ethyl-3-(hexylcarbamoylamino)pyrazole-4-carboxylic acid Formula: C13H22N4O3 MolecularWeight: 282.33878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)NC1=NN(C=C1C(=O)O)CC

Isomeric SMILES

CCCCCCNC(=O)NC1=NN(C=C1C(=O)O)CC

InChI

InChI=1S/C13H22N4O3/c1-3-5-6-7-8-14-13(20)15-11-10(12(18)19)9-17(4-2)16-11/h9H,3-8H2,1-2H3,(H,18,19)(H2,14,15,16,20)