methyl 5-[[3,5-bis(3,4-dimethylphenyl)-4-methyl-pyrazol-1-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[3,5-bis(3,4-dimethylphenyl)-4-methyl-pyrazol-1-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[3,5-bis(3,4-dimethylphenyl)-4-methyl-pyrazol-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[3,5-bis(3,4-dimethylphenyl)-4-methyl-1-pyrazolyl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[3,5-bis(3,4-dimethylphenyl)-4-methylpyrazol-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[3,5-bis(3,4-dimethylphenyl)-4-methyl-pyrazol-1-yl]methyl]furan-2-carboxylic acid methyl ester Formula: C27H28N2O3 MolecularWeight: 428.52282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C(=NN2CC3=CC=C(O3)C(=O)OC)C4=CC(=C(C=C4)C)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C(=NN2CC3=CC=C(O3)C(=O)OC)C4=CC(=C(C=C4)C)C)C)C

InChI

InChI=1S/C27H28N2O3/c1-16-7-9-21(13-18(16)3)25-20(5)26(22-10-8-17(2)19(4)14-22)29(28-25)15-23-11-12-24(32-23)27(30)31-6/h7-14H,15H2,1-6H3