[4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] pyridine-4-carboxylate

Systemtic Name: [4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] pyridine-4-carboxylate Openeye Name: [4-[(E)-2-(2-acetamido-4-pyridyl)vinyl]phenyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [4-[(E)-2-(2-acetamido-4-pyridinyl)ethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [4-[(E)-2-(2-acetamido-4-pyridyl)vinyl]phenyl] ester Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=CC(=C1)C=CC2=CC=C(C=C2)OC(=O)C3=CC=NC=C3

Isomeric SMILES

CC(=O)NC1=NC=CC(=C1)/C=C/C2=CC=C(C=C2)OC(=O)C3=CC=NC=C3

InChI

InChI=1S/C21H17N3O3/c1-15(25)24-20-14-17(8-13-23-20)3-2-16-4-6-19(7-5-16)27-21(26)18-9-11-22-12-10-18/h2-14H,1H3,(H,23,24,25)/b3-2+