methyl 1-[[5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[5-chloro-3-methyl-1-(p-tolylmethyl)pyrazole-4-carbonyl]amino]cyclohexanecarboxylate CAS Name: 1-[[[5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-4-pyrazolyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[5-chloro-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carbonyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[5-chloro-3-methyl-1-(4-methylbenzyl)pyrazole-4-carbonyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C21H26ClN3O3 MolecularWeight: 403.90244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NC3(CCCCC3)C(=O)OC)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NC3(CCCCC3)C(=O)OC)Cl

InChI

InChI=1S/C21H26ClN3O3/c1-14-7-9-16(10-8-14)13-25-18(22)17(15(2)24-25)19(26)23-21(20(27)28-3)11-5-4-6-12-21/h7-10H,4-6,11-13H2,1-3H3,(H,23,26)