[4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] pyridine-3-carboxylate

Systemtic Name: [4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] pyridine-3-carboxylate Openeye Name: [4-[(E)-2-(2-acetamido-4-pyridyl)vinyl]phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [4-[(E)-2-(2-acetamido-4-pyridinyl)ethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] pyridine-3-carboxylate Traditional Name: nicotinic 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=CN=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H17N3O3/c1-15(25)24-20-13-17(10-12-23-20)5-4-16-6-8-19(9-7-16)27-21(26)18-3-2-11-22-14-18/h2-14H,1H3,(H,23,24,25)/b5-4+