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

Systemtic Name: 3-(cyclohexylmethylamino)-5-methyl-1H-pyrazole-4-carboxylic acid Openeye Name: 3-(cyclohexylmethylamino)-5-methyl-1H-pyrazole-4-carboxylic acid CAS Name: 3-(cyclohexylmethylamino)-5-methyl-1H-pyrazole-4-carboxylic acid IUPAC Name: 3-(cyclohexylmethylamino)-5-methyl-1H-pyrazole-4-carboxylic acid Traditional Name: 3-(cyclohexylmethylamino)-5-methyl-1H-pyrazole-4-carboxylic acid Formula: C12H19N3O2 MolecularWeight: 237.29816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)NCC2CCCCC2)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1)NCC2CCCCC2)C(=O)O

InChI

InChI=1S/C12H19N3O2/c1-8-10(12(16)17)11(15-14-8)13-7-9-5-3-2-4-6-9/h9H,2-7H2,1H3,(H,16,17)(H2,13,14,15)