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

Systemtic Name: 3-[5-(4-methylphenyl)-1-(4-propan-2-ylphenyl)pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-(4-isopropylphenyl)-5-(p-tolyl)pyrrol-2-yl]propanoic acid CAS Name: 3-[5-(4-methylphenyl)-1-(4-propan-2-ylphenyl)-2-pyrrolyl]propanoic acid IUPAC Name: 3-[5-(4-methylphenyl)-1-(4-propan-2-ylphenyl)pyrrol-2-yl]propanoic acid Traditional Name: 3-[1-p-cumenyl-5-(p-tolyl)pyrrol-2-yl]propionic acid Formula: C23H25NO2 MolecularWeight: 347.4501

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(N2C3=CC=C(C=C3)C(C)C)CCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(N2C3=CC=C(C=C3)C(C)C)CCC(=O)O

InChI

InChI=1S/C23H25NO2/c1-16(2)18-8-10-20(11-9-18)24-21(13-15-23(25)26)12-14-22(24)19-6-4-17(3)5-7-19/h4-12,14,16H,13,15H2,1-3H3,(H,25,26)