methyl (E)-3-[1-cyclohexyl-4-phenyl-5-(4-phenylmethoxyphenyl)pyrazol-3-yl]prop-2-enoate

Systemtic Name: methyl (E)-3-[1-cyclohexyl-4-phenyl-5-(4-phenylmethoxyphenyl)pyrazol-3-yl]prop-2-enoate Openeye Name: methyl (E)-3-[5-(4-benzyloxyphenyl)-1-cyclohexyl-4-phenyl-pyrazol-3-yl]prop-2-enoate CAS Name: (E)-3-[1-cyclohexyl-4-phenyl-5-(4-phenylmethoxyphenyl)-3-pyrazolyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[1-cyclohexyl-4-phenyl-5-(4-phenylmethoxyphenyl)pyrazol-3-yl]prop-2-enoate Traditional Name: (E)-3-[5-(4-benzoxyphenyl)-1-cyclohexyl-4-phenyl-pyrazol-3-yl]acrylic acid methyl ester Formula: C32H32N2O3 MolecularWeight: 492.60808

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=NN(C(=C1C2=CC=CC=C2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C5CCCCC5

Isomeric SMILES

COC(=O)/C=C/C1=NN(C(=C1C2=CC=CC=C2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C5CCCCC5

InChI

InChI=1S/C32H32N2O3/c1-36-30(35)22-21-29-31(25-13-7-3-8-14-25)32(34(33-29)27-15-9-4-10-16-27)26-17-19-28(20-18-26)37-23-24-11-5-2-6-12-24/h2-3,5-8,11-14,17-22,27H,4,9-10,15-16,23H2,1H3/b22-21+