[1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 6-pyrazol-1-ylpyridine-3-carboxylate

Systemtic Name: [1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 6-pyrazol-1-ylpyridine-3-carboxylate Openeye Name: [2-(cyclohexylmethylamino)-1-methyl-2-oxo-ethyl] 6-pyrazol-1-ylpyridine-3-carboxylate CAS Name: 6-(1-pyrazolyl)-3-pyridinecarboxylic acid [1-(cyclohexylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclohexylmethylamino)-1-oxopropan-2-yl] 6-pyrazol-1-ylpyridine-3-carboxylate Traditional Name: 6-pyrazol-1-ylnicotinic acid [2-(cyclohexylmethylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H24N4O3 MolecularWeight: 356.41886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCCCC1)OC(=O)C2=CN=C(C=C2)N3C=CC=N3

Isomeric SMILES

CC(C(=O)NCC1CCCCC1)OC(=O)C2=CN=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C19H24N4O3/c1-14(18(24)21-12-15-6-3-2-4-7-15)26-19(25)16-8-9-17(20-13-16)23-11-5-10-22-23/h5,8-11,13-15H,2-4,6-7,12H2,1H3,(H,21,24)