3-(heptylamino)-5-methyl-1H-pyrazole-4-carboxylic acid

Systemtic Name: 3-(heptylamino)-5-methyl-1H-pyrazole-4-carboxylic acid Openeye Name: 3-(heptylamino)-5-methyl-1H-pyrazole-4-carboxylic acid CAS Name: 3-(heptylamino)-5-methyl-1H-pyrazole-4-carboxylic acid IUPAC Name: 3-(heptylamino)-5-methyl-1H-pyrazole-4-carboxylic acid Traditional Name: 3-(heptylamino)-5-methyl-1H-pyrazole-4-carboxylic acid Formula: C12H21N3O2 MolecularWeight: 239.31404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC1=NNC(=C1C(=O)O)C

Isomeric SMILES

CCCCCCCNC1=NNC(=C1C(=O)O)C

InChI

InChI=1S/C12H21N3O2/c1-3-4-5-6-7-8-13-11-10(12(16)17)9(2)14-15-11/h3-8H2,1-2H3,(H,16,17)(H2,13,14,15)