methyl 4-[[4-ethyl-3,5-bis(3-methoxyphenyl)pyrazol-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[4-ethyl-3,5-bis(3-methoxyphenyl)pyrazol-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-ethyl-3,5-bis(3-methoxyphenyl)pyrazol-1-yl]methyl]benzoate CAS Name: 4-[[4-ethyl-3,5-bis(3-methoxyphenyl)-1-pyrazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-ethyl-3,5-bis(3-methoxyphenyl)pyrazol-1-yl]methyl]benzoate Traditional Name: 4-[[4-ethyl-3,5-bis(3-methoxyphenyl)pyrazol-1-yl]methyl]benzoic acid methyl ester Formula: C28H28N2O4 MolecularWeight: 456.53292

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(N=C1C2=CC(=CC=C2)OC)CC3=CC=C(C=C3)C(=O)OC)C4=CC(=CC=C4)OC

Isomeric SMILES

CCC1=C(N(N=C1C2=CC(=CC=C2)OC)CC3=CC=C(C=C3)C(=O)OC)C4=CC(=CC=C4)OC

InChI

InChI=1S/C28H28N2O4/c1-5-25-26(21-8-6-10-23(16-21)32-2)29-30(27(25)22-9-7-11-24(17-22)33-3)18-19-12-14-20(15-13-19)28(31)34-4/h6-17H,5,18H2,1-4H3