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

Systemtic Name: [4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] 3-methylbenzoate Openeye Name: [4-[(E)-2-(2-acetamido-4-pyridyl)vinyl]phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [4-[(E)-2-(2-acetamido-4-pyridinyl)ethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [4-[(E)-2-(2-acetamido-4-pyridyl)vinyl]phenyl] ester Formula: C23H20N2O3 MolecularWeight: 372.4165

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)C=CC3=CC(=NC=C3)NC(=O)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)/C=C/C3=CC(=NC=C3)NC(=O)C

InChI

InChI=1S/C23H20N2O3/c1-16-4-3-5-20(14-16)23(27)28-21-10-8-18(9-11-21)6-7-19-12-13-24-22(15-19)25-17(2)26/h3-15H,1-2H3,(H,24,25,26)/b7-6+