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

Systemtic Name: [2-ethoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] 3-methylbenzoate Openeye Name: [2-ethoxy-4-[(E)-2-(4-pyridyl)vinyl]phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [2-ethoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] ester IUPAC Name: [2-ethoxy-4-[(E)-2-pyridin-4-ylethenyl]phenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [2-ethoxy-4-[(E)-2-(4-pyridyl)vinyl]phenyl] ester Formula: C23H21NO3 MolecularWeight: 359.41774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC2=CC=NC=C2)OC(=O)C3=CC(=CC=C3)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C2=CC=NC=C2)OC(=O)C3=CC(=CC=C3)C

InChI

InChI=1S/C23H21NO3/c1-3-26-22-16-19(8-7-18-11-13-24-14-12-18)9-10-21(22)27-23(25)20-6-4-5-17(2)15-20/h4-16H,3H2,1-2H3/b8-7+