2-(4-carboxyphenyl)-5-(2,5-dimethylpyrrol-1-yl)benzoic acid

Systemtic Name: 2-(4-carboxyphenyl)-5-(2,5-dimethylpyrrol-1-yl)benzoic acid Openeye Name: 2-(4-carboxyphenyl)-5-(2,5-dimethylpyrrol-1-yl)benzoic acid CAS Name: 2-(4-carboxyphenyl)-5-(2,5-dimethyl-1-pyrrolyl)benzoic acid IUPAC Name: 2-(4-carboxyphenyl)-5-(2,5-dimethylpyrrol-1-yl)benzoic acid Traditional Name: 2-(4-carboxyphenyl)-5-(2,5-dimethylpyrrol-1-yl)benzoic acid Formula: C20H17NO4 MolecularWeight: 335.35328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC(=C(C=C2)C3=CC=C(C=C3)C(=O)O)C(=O)O)C

Isomeric SMILES

CC1=CC=C(N1C2=CC(=C(C=C2)C3=CC=C(C=C3)C(=O)O)C(=O)O)C

InChI

InChI=1S/C20H17NO4/c1-12-3-4-13(2)21(12)16-9-10-17(18(11-16)20(24)25)14-5-7-15(8-6-14)19(22)23/h3-11H,1-2H3,(H,22,23)(H,24,25)