5-[butan-2-yl(ethyl)amino]-1,3-dimethyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[butan-2-yl(ethyl)amino]-1,3-dimethyl-pyrazole-4-carboxylic acid Openeye Name: 5-[ethyl(sec-butyl)amino]-1,3-dimethyl-pyrazole-4-carboxylic acid CAS Name: 5-[butan-2-yl(ethyl)amino]-1,3-dimethyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[butan-2-yl(ethyl)amino]-1,3-dimethylpyrazole-4-carboxylic acid Traditional Name: 5-[ethyl(sec-butyl)amino]-1,3-dimethyl-pyrazole-4-carboxylic acid Formula: C12H21N3O2 MolecularWeight: 239.31404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC)C1=C(C(=NN1C)C)C(=O)O

Isomeric SMILES

CCC(C)N(CC)C1=C(C(=NN1C)C)C(=O)O

InChI

InChI=1S/C12H21N3O2/c1-6-8(3)15(7-2)11-10(12(16)17)9(4)13-14(11)5/h8H,6-7H2,1-5H3,(H,16,17)