methyl 2-[[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-amino]methyl]furan-3-carboxylate

Systemtic Name: methyl 2-[[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-amino]methyl]furan-3-carboxylate Openeye Name: methyl 2-[[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-amino]methyl]furan-3-carboxylate CAS Name: 2-[[[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]methyl-methylamino]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-[[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methyl-methylamino]methyl]furan-3-carboxylate Traditional Name: 2-[[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-amino]methyl]furan-3-carboxylic acid methyl ester Formula: C24H22ClN3O3 MolecularWeight: 435.90278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1C2=CC=C(C=C2)Cl)C3=CC=CC=C3)CC4=C(C=CO4)C(=O)OC

Isomeric SMILES

CN(CC1=CN(N=C1C2=CC=C(C=C2)Cl)C3=CC=CC=C3)CC4=C(C=CO4)C(=O)OC

InChI

InChI=1S/C24H22ClN3O3/c1-27(16-22-21(12-13-31-22)24(29)30-2)14-18-15-28(20-6-4-3-5-7-20)26-23(18)17-8-10-19(25)11-9-17/h3-13,15H,14,16H2,1-2H3