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

Systemtic Name: methyl 4-[[3,5-bis(3,4-dimethoxyphenyl)-4-methyl-pyrazol-1-yl]methyl]benzoate Openeye Name: methyl 4-[[3,5-bis(3,4-dimethoxyphenyl)-4-methyl-pyrazol-1-yl]methyl]benzoate CAS Name: 4-[[3,5-bis(3,4-dimethoxyphenyl)-4-methyl-1-pyrazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3,5-bis(3,4-dimethoxyphenyl)-4-methylpyrazol-1-yl]methyl]benzoate Traditional Name: 4-[[3,5-bis(3,4-dimethoxyphenyl)-4-methyl-pyrazol-1-yl]methyl]benzoic acid methyl ester Formula: C29H30N2O6 MolecularWeight: 502.5583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C2=CC(=C(C=C2)OC)OC)CC3=CC=C(C=C3)C(=O)OC)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=C(N(N=C1C2=CC(=C(C=C2)OC)OC)CC3=CC=C(C=C3)C(=O)OC)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C29H30N2O6/c1-18-27(21-11-13-23(33-2)25(15-21)35-4)30-31(17-19-7-9-20(10-8-19)29(32)37-6)28(18)22-12-14-24(34-3)26(16-22)36-5/h7-16H,17H2,1-6H3