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

Systemtic Name: [4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] 3,4-dimethylbenzoate Openeye Name: [4-[(E)-2-(2-acetamido-4-pyridyl)vinyl]phenyl] 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid [4-[(E)-2-(2-acetamido-4-pyridinyl)ethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid [4-[(E)-2-(2-acetamido-4-pyridyl)vinyl]phenyl] ester Formula: C24H22N2O3 MolecularWeight: 386.44308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22N2O3/c1-16-4-9-21(14-17(16)2)24(28)29-22-10-7-19(8-11-22)5-6-20-12-13-25-23(15-20)26-18(3)27/h4-15H,1-3H3,(H,25,26,27)/b6-5+