methyl 1-[[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[1-[(2-chlorophenyl)methyl]pyrazole-4-carbonyl]amino]cyclohexanecarboxylate CAS Name: 1-[[[1-[(2-chlorophenyl)methyl]-4-pyrazolyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[1-[(2-chlorophenyl)methyl]pyrazole-4-carbonyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[1-(2-chlorobenzyl)pyrazole-4-carbonyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C19H22ClN3O3 MolecularWeight: 375.84928

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3Cl

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C19H22ClN3O3/c1-26-18(25)19(9-5-2-6-10-19)22-17(24)15-11-21-23(13-15)12-14-7-3-4-8-16(14)20/h3-4,7-8,11,13H,2,5-6,9-10,12H2,1H3,(H,22,24)