3-[5-[3-(dimethylamino)phenyl]-2-(4-methoxyphenyl)pyrazol-3-yl]-2-(3-methylphenyl)propanoic acid

Systemtic Name: 3-[5-[3-(dimethylamino)phenyl]-2-(4-methoxyphenyl)pyrazol-3-yl]-2-(3-methylphenyl)propanoic acid Openeye Name: 3-[5-[3-(dimethylamino)phenyl]-2-(4-methoxyphenyl)pyrazol-3-yl]-2-(m-tolyl)propanoic acid CAS Name: 3-[5-[3-(dimethylamino)phenyl]-2-(4-methoxyphenyl)-3-pyrazolyl]-2-(3-methylphenyl)propanoic acid IUPAC Name: 3-[5-[3-(dimethylamino)phenyl]-2-(4-methoxyphenyl)pyrazol-3-yl]-2-(3-methylphenyl)propanoic acid Traditional Name: 3-[5-[3-(dimethylamino)phenyl]-2-(4-methoxyphenyl)pyrazol-3-yl]-2-(m-tolyl)propionic acid Formula: C28H29N3O3 MolecularWeight: 455.54816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(CC2=CC(=NN2C3=CC=C(C=C3)OC)C4=CC(=CC=C4)N(C)C)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)C(CC2=CC(=NN2C3=CC=C(C=C3)OC)C4=CC(=CC=C4)N(C)C)C(=O)O

InChI

InChI=1S/C28H29N3O3/c1-19-7-5-8-20(15-19)26(28(32)33)17-24-18-27(21-9-6-10-23(16-21)30(2)3)29-31(24)22-11-13-25(34-4)14-12-22/h5-16,18,26H,17H2,1-4H3,(H,32,33)