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

Systemtic Name: ethyl 4-[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]-4-oxidanyl-cyclohexane-1-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C26H30N2O4 MolecularWeight: 434.5274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(CC1)(C2=NN(C(=C2)C3=CC=C(C=C3)C)C4=CC=C(C=C4)OC)O

Isomeric SMILES

CCOC(=O)C1CCC(CC1)(C2=NN(C(=C2)C3=CC=C(C=C3)C)C4=CC=C(C=C4)OC)O

InChI

InChI=1S/C26H30N2O4/c1-4-32-25(29)20-13-15-26(30,16-14-20)24-17-23(19-7-5-18(2)6-8-19)28(27-24)21-9-11-22(31-3)12-10-21/h5-12,17,20,30H,4,13-16H2,1-3H3