2-[(E)-2-(3-bromophenyl)ethenyl]quinoline-4-carboxylate

Systemtic Name: 2-[(E)-2-(3-bromophenyl)ethenyl]quinoline-4-carboxylate Openeye Name: 2-[(E)-2-(3-bromophenyl)vinyl]quinoline-4-carboxylate CAS Name: 2-[(E)-2-(3-bromophenyl)ethenyl]-4-quinolinecarboxylate IUPAC Name: 2-[(E)-2-(3-bromophenyl)ethenyl]quinoline-4-carboxylate Traditional Name: 2-[(E)-2-(3-bromophenyl)vinyl]cinchoninate Formula: C18H11BrNO2- MolecularWeight: 353.18944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C=CC3=CC(=CC=C3)Br)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)/C=C/C3=CC(=CC=C3)Br)C(=O)[O-]

InChI

InChI=1S/C18H12BrNO2/c19-13-5-3-4-12(10-13)8-9-14-11-16(18(21)22)15-6-1-2-7-17(15)20-14/h1-11H,(H,21,22)/p-1/b9-8+