[4-[(E)-2-pyridin-2-ylethenyl]phenyl] 3,5-dimethoxybenzoate

Systemtic Name: [4-[(E)-2-pyridin-2-ylethenyl]phenyl] 3,5-dimethoxybenzoate Openeye Name: [4-[(E)-2-(2-pyridyl)vinyl]phenyl] 3,5-dimethoxybenzoate CAS Name: 3,5-dimethoxybenzoic acid [4-[(E)-2-(2-pyridinyl)ethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-pyridin-2-ylethenyl]phenyl] 3,5-dimethoxybenzoate Traditional Name: 3,5-dimethoxybenzoic acid [4-[(E)-2-(2-pyridyl)vinyl]phenyl] ester Formula: C22H19NO4 MolecularWeight: 361.39056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)OC2=CC=C(C=C2)C=CC3=CC=CC=N3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)OC2=CC=C(C=C2)/C=C/C3=CC=CC=N3)OC

InChI

InChI=1S/C22H19NO4/c1-25-20-13-17(14-21(15-20)26-2)22(24)27-19-10-7-16(8-11-19)6-9-18-5-3-4-12-23-18/h3-15H,1-2H3/b9-6+