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

Systemtic Name: 3-[5-(4-methylphenyl)-1-[(4-methylphenyl)carbonylamino]pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-[(4-methylbenzoyl)amino]-5-(p-tolyl)pyrrol-2-yl]propanoic acid CAS Name: 3-[5-(4-methylphenyl)-1-[[(4-methylphenyl)-oxomethyl]amino]-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-[(4-methylbenzoyl)amino]-5-(4-methylphenyl)pyrrol-2-yl]propanoic acid Traditional Name: 3-[1-(p-toluoylamino)-5-(p-tolyl)pyrrol-2-yl]propionic acid Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(N2NC(=O)C3=CC=C(C=C3)C)CCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(N2NC(=O)C3=CC=C(C=C3)C)CCC(=O)O

InChI

InChI=1S/C22H22N2O3/c1-15-3-7-17(8-4-15)20-13-11-19(12-14-21(25)26)24(20)23-22(27)18-9-5-16(2)6-10-18/h3-11,13H,12,14H2,1-2H3,(H,23,27)(H,25,26)