[4-[(E)-2-pyridin-2-ylethenyl]phenyl] 4-methylbenzoate

Systemtic Name: [4-[(E)-2-pyridin-2-ylethenyl]phenyl] 4-methylbenzoate Openeye Name: [4-[(E)-2-(2-pyridyl)vinyl]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[(E)-2-(2-pyridinyl)ethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-pyridin-2-ylethenyl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[(E)-2-(2-pyridyl)vinyl]phenyl] ester Formula: C21H17NO2 MolecularWeight: 315.36518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=CC3=CC=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=C/C3=CC=CC=N3

InChI

InChI=1S/C21H17NO2/c1-16-5-10-18(11-6-16)21(23)24-20-13-8-17(9-14-20)7-12-19-4-2-3-15-22-19/h2-15H,1H3/b12-7+