6-bromanyl-2-[(E)-2-(2-methylphenyl)ethenyl]quinoline-4-carboxylate

Systemtic Name: 6-bromanyl-2-[(E)-2-(2-methylphenyl)ethenyl]quinoline-4-carboxylate Openeye Name: 6-bromo-2-[(E)-2-(o-tolyl)vinyl]quinoline-4-carboxylate CAS Name: 6-bromo-2-[(E)-2-(2-methylphenyl)ethenyl]-4-quinolinecarboxylate IUPAC Name: 6-bromo-2-[(E)-2-(2-methylphenyl)ethenyl]quinoline-4-carboxylate Traditional Name: 6-bromo-2-[(E)-2-(o-tolyl)vinyl]cinchoninate Formula: C19H13BrNO2- MolecularWeight: 367.21602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=CC2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1/C=C/C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)[O-]

InChI

InChI=1S/C19H14BrNO2/c1-12-4-2-3-5-13(12)6-8-15-11-17(19(22)23)16-10-14(20)7-9-18(16)21-15/h2-11H,1H3,(H,22,23)/p-1/b8-6+