methyl 4-[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]-4-oxidanyl-cyclohexane-1-carboxylate

Systemtic Name: methyl 4-[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]-4-oxidanyl-cyclohexane-1-carboxylate Openeye Name: methyl 4-hydroxy-4-[1-(4-methoxyphenyl)-5-(p-tolyl)pyrazol-3-yl]cyclohexanecarboxylate CAS Name: 4-hydroxy-4-[1-(4-methoxyphenyl)-5-(4-methylphenyl)-3-pyrazolyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-hydroxy-4-[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]cyclohexane-1-carboxylate Traditional Name: 4-hydroxy-4-[1-(4-methoxyphenyl)-5-(p-tolyl)pyrazol-3-yl]cyclohexanecarboxylic acid methyl ester Formula: C25H28N2O4 MolecularWeight: 420.50082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)OC)C4(CCC(CC4)C(=O)OC)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)OC)C4(CCC(CC4)C(=O)OC)O

InChI

InChI=1S/C25H28N2O4/c1-17-4-6-18(7-5-17)22-16-23(25(29)14-12-19(13-15-25)24(28)31-3)26-27(22)20-8-10-21(30-2)11-9-20/h4-11,16,19,29H,12-15H2,1-3H3