4-[6-(2,5-dimethylpyrrol-2-yl)pyridin-2-yl]benzoic acid

Systemtic Name: 4-[6-(2,5-dimethylpyrrol-2-yl)pyridin-2-yl]benzoic acid Openeye Name: 4-[6-(2,5-dimethylpyrrol-2-yl)-2-pyridyl]benzoic acid CAS Name: 4-[6-(2,5-dimethyl-2-pyrrolyl)-2-pyridinyl]benzoic acid IUPAC Name: 4-[6-(2,5-dimethylpyrrol-2-yl)pyridin-2-yl]benzoic acid Traditional Name: 4-[6-(2,5-dimethylpyrrol-2-yl)-2-pyridyl]benzoic acid Formula: C18H16N2O2 MolecularWeight: 292.33184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(C=C1)(C)C2=CC=CC(=N2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=NC(C=C1)(C)C2=CC=CC(=N2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H16N2O2/c1-12-10-11-18(2,20-12)16-5-3-4-15(19-16)13-6-8-14(9-7-13)17(21)22/h3-11H,1-2H3,(H,21,22)