2,6-dimethyl-1-[2-[(E)-2-pyridin-2-ylethenyl]phenyl]-4H-pyridine-3,5-dicarboxylic acid

Systemtic Name: 2,6-dimethyl-1-[2-[(E)-2-pyridin-2-ylethenyl]phenyl]-4H-pyridine-3,5-dicarboxylic acid Openeye Name: 2,6-dimethyl-1-[2-[(E)-2-(2-pyridyl)vinyl]phenyl]-4H-pyridine-3,5-dicarboxylic acid CAS Name: 2,6-dimethyl-1-[2-[(E)-2-(2-pyridinyl)ethenyl]phenyl]-4H-pyridine-3,5-dicarboxylic acid IUPAC Name: 2,6-dimethyl-1-[2-[(E)-2-pyridin-2-ylethenyl]phenyl]-4H-pyridine-3,5-dicarboxylic acid Traditional Name: 2,6-dimethyl-1-[2-[(E)-2-(2-pyridyl)vinyl]phenyl]-4H-pyridine-3,5-dicarboxylic acid Formula: C22H20N2O4 MolecularWeight: 376.4052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(=C(N1C2=CC=CC=C2C=CC3=CC=CC=N3)C)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(CC(=C(N1C2=CC=CC=C2/C=C/C3=CC=CC=N3)C)C(=O)O)C(=O)O

InChI

InChI=1S/C22H20N2O4/c1-14-18(21(25)26)13-19(22(27)28)15(2)24(14)20-9-4-3-7-16(20)10-11-17-8-5-6-12-23-17/h3-12H,13H2,1-2H3,(H,25,26)(H,27,28)/b11-10+