methyl 6-[[1-(4-cyanobutyl)pyrazol-4-yl]carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl 6-[[1-(4-cyanobutyl)pyrazol-4-yl]carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: methyl 6-[[1-(4-cyanobutyl)pyrazol-4-yl]carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: 6-[[[1-(4-cyanobutyl)-4-pyrazolyl]amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl 6-[[1-(4-cyanobutyl)pyrazol-4-yl]carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: 6-[[1-(4-cyanobutyl)pyrazol-4-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC=CCC1C(=O)NC2=CN(N=C2)CCCCC#N

Isomeric SMILES

COC(=O)C1CC=CCC1C(=O)NC2=CN(N=C2)CCCCC#N

InChI

InChI=1S/C17H22N4O3/c1-24-17(23)15-8-4-3-7-14(15)16(22)20-13-11-19-21(12-13)10-6-2-5-9-18/h3-4,11-12,14-15H,2,5-8,10H2,1H3,(H,20,22)