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

Systemtic Name: [4-[(E)-2-pyridin-2-ylethenyl]phenyl] 4-bromanylbenzoate Openeye Name: [4-[(E)-2-(2-pyridyl)vinyl]phenyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [4-[(E)-2-(2-pyridinyl)ethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-pyridin-2-ylethenyl]phenyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [4-[(E)-2-(2-pyridyl)vinyl]phenyl] ester Formula: C20H14BrNO2 MolecularWeight: 380.23466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14BrNO2/c21-17-9-7-16(8-10-17)20(23)24-19-12-5-15(6-13-19)4-11-18-3-1-2-14-22-18/h1-14H/b11-4+