[4-[(E)-2-pyridin-4-ylethenyl]phenyl] 3-methylbutanoate

Systemtic Name: [4-[(E)-2-pyridin-4-ylethenyl]phenyl] 3-methylbutanoate Openeye Name: [4-[(E)-2-(4-pyridyl)vinyl]phenyl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [4-[(E)-2-pyridin-4-ylethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-pyridin-4-ylethenyl]phenyl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [4-[(E)-2-(4-pyridyl)vinyl]phenyl] ester Formula: C18H19NO2 MolecularWeight: 281.34896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO2/c1-14(2)13-18(20)21-17-7-5-15(6-8-17)3-4-16-9-11-19-12-10-16/h3-12,14H,13H2,1-2H3/b4-3+