3-[1-(2,4-dimethylphenyl)-5-(4-methylphenyl)pyrrol-2-yl]propanoate

Systemtic Name: 3-[1-(2,4-dimethylphenyl)-5-(4-methylphenyl)pyrrol-2-yl]propanoate Openeye Name: 3-[1-(2,4-dimethylphenyl)-5-(p-tolyl)pyrrol-2-yl]propanoate CAS Name: 3-[1-(2,4-dimethylphenyl)-5-(4-methylphenyl)-2-pyrrolyl]propanoate IUPAC Name: 3-[1-(2,4-dimethylphenyl)-5-(4-methylphenyl)pyrrol-2-yl]propanoate Traditional Name: 3-[1-(2,4-dimethylphenyl)-5-(p-tolyl)pyrrol-2-yl]propionate Formula: C22H22NO2- MolecularWeight: 332.41558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO2/c1-15-4-7-18(8-5-15)21-12-9-19(10-13-22(24)25)23(21)20-11-6-16(2)14-17(20)3/h4-9,11-12,14H,10,13H2,1-3H3,(H,24,25)/p-1