3-[(E)-4-[2-(4-methylphenyl)phenyl]but-3-en-1-ynyl]pyridine-2-carboxylate

Systemtic Name: 3-[(E)-4-[2-(4-methylphenyl)phenyl]but-3-en-1-ynyl]pyridine-2-carboxylate Openeye Name: 3-[(E)-4-[2-(p-tolyl)phenyl]but-3-en-1-ynyl]pyridine-2-carboxylate CAS Name: 3-[(E)-4-[2-(4-methylphenyl)phenyl]but-3-en-1-ynyl]-2-pyridinecarboxylate IUPAC Name: 3-[(E)-4-[2-(4-methylphenyl)phenyl]but-3-en-1-ynyl]pyridine-2-carboxylate Traditional Name: 3-[(E)-4-[2-(p-tolyl)phenyl]but-3-en-1-ynyl]picolinate Formula: C23H16NO2- MolecularWeight: 338.37864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=CC=C2C=CC#CC3=C(N=CC=C3)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=CC=C2/C=C/C#CC3=C(N=CC=C3)C(=O)[O-]

InChI

InChI=1S/C23H17NO2/c1-17-12-14-19(15-13-17)21-11-5-4-8-18(21)7-2-3-9-20-10-6-16-24-22(20)23(25)26/h2,4-8,10-16H,1H3,(H,25,26)/p-1/b7-2+