3-[1-(2-methylphenyl)-5-(4-methylphenyl)pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[1-(2-methylphenyl)-5-(4-methylphenyl)pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-(o-tolyl)-5-(p-tolyl)pyrrol-2-yl]propanoic acid CAS Name: 3-[1-(2-methylphenyl)-5-(4-methylphenyl)-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-(2-methylphenyl)-5-(4-methylphenyl)pyrrol-2-yl]propanoic acid Traditional Name: 3-[1-(o-tolyl)-5-(p-tolyl)pyrrol-2-yl]propionic acid Formula: C21H21NO2 MolecularWeight: 319.39694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(N2C3=CC=CC=C3C)CCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(N2C3=CC=CC=C3C)CCC(=O)O

InChI

InChI=1S/C21H21NO2/c1-15-7-9-17(10-8-15)20-13-11-18(12-14-21(23)24)22(20)19-6-4-3-5-16(19)2/h3-11,13H,12,14H2,1-2H3,(H,23,24)