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

Systemtic Name: [4-[(E)-2-pyridin-2-ylethenyl]phenyl] 3-bromanylbenzoate Openeye Name: [4-[(E)-2-(2-pyridyl)vinyl]phenyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [4-[(E)-2-(2-pyridinyl)ethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-pyridin-2-ylethenyl]phenyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [4-[(E)-2-(2-pyridyl)vinyl]phenyl] ester Formula: C20H14BrNO2 MolecularWeight: 380.23466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14BrNO2/c21-17-5-3-4-16(14-17)20(23)24-19-11-8-15(9-12-19)7-10-18-6-1-2-13-22-18/h1-14H/b10-7+