2-[3-(4-pyridin-4-ylphenyl)pyrrol-1-yl]butanedioic acid

Systemtic Name: 2-[3-(4-pyridin-4-ylphenyl)pyrrol-1-yl]butanedioic acid Openeye Name: 2-[3-[4-(4-pyridyl)phenyl]pyrrol-1-yl]butanedioic acid CAS Name: 2-[3-(4-pyridin-4-ylphenyl)-1-pyrrolyl]butanedioic acid IUPAC Name: 2-[3-(4-pyridin-4-ylphenyl)pyrrol-1-yl]butanedioic acid Traditional Name: 2-[3-[4-(4-pyridyl)phenyl]pyrrol-1-yl]succinic acid Formula: C19H16N2O4 MolecularWeight: 336.34134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=NC=C2)C3=CN(C=C3)C(CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=CC=NC=C2)C3=CN(C=C3)C(CC(=O)O)C(=O)O

InChI

InChI=1S/C19H16N2O4/c22-18(23)11-17(19(24)25)21-10-7-16(12-21)14-3-1-13(2-4-14)15-5-8-20-9-6-15/h1-10,12,17H,11H2,(H,22,23)(H,24,25)