[2-[(3R)-2-ethanoyl-3-(4-methoxyphenyl)-3,4-dihydropyrazol-5-yl]-5-methoxy-phenyl] 4-methylbenzoate

Systemtic Name: [2-[(3R)-2-ethanoyl-3-(4-methoxyphenyl)-3,4-dihydropyrazol-5-yl]-5-methoxy-phenyl] 4-methylbenzoate Openeye Name: [2-[(3R)-2-acetyl-3-(4-methoxyphenyl)-3,4-dihydropyrazol-5-yl]-5-methoxy-phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-[(3R)-2-acetyl-3-(4-methoxyphenyl)-3,4-dihydropyrazol-5-yl]-5-methoxyphenyl] ester IUPAC Name: [2-[(3R)-2-acetyl-3-(4-methoxyphenyl)-3,4-dihydropyrazol-5-yl]-5-methoxyphenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-[(5R)-1-acetyl-5-(4-methoxyphenyl)-2-pyrazolin-3-yl]-5-methoxy-phenyl] ester Formula: C27H26N2O5 MolecularWeight: 458.50574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)OC)C3=NN(C(C3)C4=CC=C(C=C4)OC)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)OC)C3=NN([C@H](C3)C4=CC=C(C=C4)OC)C(=O)C

InChI

InChI=1S/C27H26N2O5/c1-17-5-7-20(8-6-17)27(31)34-26-15-22(33-4)13-14-23(26)24-16-25(29(28-24)18(2)30)19-9-11-21(32-3)12-10-19/h5-15,25H,16H2,1-4H3/t25-/m1/s1