1-[1-[cyclohexyl(methyl)amino]-1-oxidanylidene-propan-2-yl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[1-[cyclohexyl(methyl)amino]-1-oxidanylidene-propan-2-yl]pyrazole-4-carboxylic acid Openeye Name: 1-[2-[cyclohexyl(methyl)amino]-1-methyl-2-oxo-ethyl]pyrazole-4-carboxylic acid CAS Name: 1-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]pyrazole-4-carboxylic acid Traditional Name: 1-[2-[cyclohexyl(methyl)amino]-2-keto-1-methyl-ethyl]pyrazole-4-carboxylic acid Formula: C14H21N3O3 MolecularWeight: 279.33484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1CCCCC1)N2C=C(C=N2)C(=O)O

Isomeric SMILES

CC(C(=O)N(C)C1CCCCC1)N2C=C(C=N2)C(=O)O

InChI

InChI=1S/C14H21N3O3/c1-10(17-9-11(8-15-17)14(19)20)13(18)16(2)12-6-4-3-5-7-12/h8-10,12H,3-7H2,1-2H3,(H,19,20)