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

Systemtic Name: 2-[(E)-2-(3-bromophenyl)ethenyl]quinoline-4-carboxylic acid Openeye Name: 2-[(E)-2-(3-bromophenyl)vinyl]quinoline-4-carboxylic acid CAS Name: 2-[(E)-2-(3-bromophenyl)ethenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[(E)-2-(3-bromophenyl)ethenyl]quinoline-4-carboxylic acid Traditional Name: 2-[(E)-2-(3-bromophenyl)vinyl]cinchoninic acid Formula: C18H12BrNO2 MolecularWeight: 354.19738

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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)/b9-8+