2-[5-(2-carboxyphenyl)-1-(4-methylphenyl)pyrrol-2-yl]benzoic acid

Systemtic Name: 2-[5-(2-carboxyphenyl)-1-(4-methylphenyl)pyrrol-2-yl]benzoic acid Openeye Name: 2-[5-(2-carboxyphenyl)-1-(p-tolyl)pyrrol-2-yl]benzoic acid CAS Name: 2-[5-(2-carboxyphenyl)-1-(4-methylphenyl)-2-pyrrolyl]benzoic acid IUPAC Name: 2-[5-(2-carboxyphenyl)-1-(4-methylphenyl)pyrrol-2-yl]benzoic acid Traditional Name: 2-[5-(2-carboxyphenyl)-1-(p-tolyl)pyrrol-2-yl]benzoic acid Formula: C25H19NO4 MolecularWeight: 397.42266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC=C2C3=CC=CC=C3C(=O)O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC=C2C3=CC=CC=C3C(=O)O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C25H19NO4/c1-16-10-12-17(13-11-16)26-22(18-6-2-4-8-20(18)24(27)28)14-15-23(26)19-7-3-5-9-21(19)25(29)30/h2-15H,1H3,(H,27,28)(H,29,30)