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

Systemtic Name: [4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] pentanoate Openeye Name: [4-[(E)-2-(2-acetamido-4-pyridyl)vinyl]phenyl] pentanoate CAS Name: pentanoic acid [4-[(E)-2-(2-acetamido-4-pyridinyl)ethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] pentanoate Traditional Name: valeric 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:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O3/c1-3-4-5-20(24)25-18-10-8-16(9-11-18)6-7-17-12-13-21-19(14-17)22-15(2)23/h6-14H,3-5H2,1-2H3,(H,21,22,23)/b7-6+