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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OC2=CC=C(C=C2)C=CC3=CC=NC=C3

Isomeric SMILES

CC1=CC=CC=C1C(=O)OC2=CC=C(C=C2)/C=C/C3=CC=NC=C3

InChI

InChI=1S/C21H17NO2/c1-16-4-2-3-5-20(16)21(23)24-19-10-8-17(9-11-19)6-7-18-12-14-22-15-13-18/h2-15H,1H3/b7-6+