6-bromanyl-2-(3-hydroxyphenyl)quinoline-4-carboxylate

Systemtic Name: 6-bromanyl-2-(3-hydroxyphenyl)quinoline-4-carboxylate Openeye Name: 6-bromo-2-(3-hydroxyphenyl)quinoline-4-carboxylate CAS Name: 6-bromo-2-(3-hydroxyphenyl)-4-quinolinecarboxylate IUPAC Name: 6-bromo-2-(3-hydroxyphenyl)quinoline-4-carboxylate Traditional Name: 6-bromo-2-(3-hydroxyphenyl)cinchoninate Formula: C16H9BrNO3- MolecularWeight: 343.15156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10BrNO3/c17-10-4-5-14-12(7-10)13(16(20)21)8-15(18-14)9-2-1-3-11(19)6-9/h1-8,19H,(H,20,21)/p-1