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

Systemtic Name: [4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] 3-methylbutanoate Openeye Name: [4-[(E)-2-(2-acetamido-4-pyridyl)vinyl]phenyl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [4-[(E)-2-(2-acetamido-4-pyridinyl)ethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [4-[(E)-2-(2-acetamido-4-pyridyl)vinyl]phenyl] ester Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)OC1=CC=C(C=C1)C=CC2=CC(=NC=C2)NC(=O)C

Isomeric SMILES

CC(C)CC(=O)OC1=CC=C(C=C1)/C=C/C2=CC(=NC=C2)NC(=O)C

InChI

InChI=1S/C20H22N2O3/c1-14(2)12-20(24)25-18-8-6-16(7-9-18)4-5-17-10-11-21-19(13-17)22-15(3)23/h4-11,13-14H,12H2,1-3H3,(H,21,22,23)/b5-4+