[2-ethoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] 2-ethylbutanoate

Systemtic Name: [2-ethoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] 2-ethylbutanoate Openeye Name: [2-ethoxy-4-[(E)-2-(4-pyridyl)vinyl]phenyl] 2-ethylbutanoate CAS Name: 2-ethylbutanoic acid [2-ethoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] ester IUPAC Name: [2-ethoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] 2-ethylbutanoate Traditional Name: 2-ethylbutyric acid [2-ethoxy-4-[(E)-2-(4-pyridyl)vinyl]phenyl] ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO3/c1-4-18(5-2)21(23)25-19-10-9-17(15-20(19)24-6-3)8-7-16-11-13-22-14-12-16/h7-15,18H,4-6H2,1-3H3/b8-7+