2-(4-aminophenyl)-6-bromanyl-quinoline-4-carboxylate

Systemtic Name: 2-(4-aminophenyl)-6-bromanyl-quinoline-4-carboxylate Openeye Name: 2-(4-aminophenyl)-6-bromo-quinoline-4-carboxylate CAS Name: 2-(4-aminophenyl)-6-bromo-4-quinolinecarboxylate IUPAC Name: 2-(4-aminophenyl)-6-bromoquinoline-4-carboxylate Traditional Name: 2-(4-aminophenyl)-6-bromo-cinchoninate Formula: C16H10BrN2O2- MolecularWeight: 342.1668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)[O-])N

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)[O-])N

InChI

InChI=1S/C16H11BrN2O2/c17-10-3-6-14-12(7-10)13(16(20)21)8-15(19-14)9-1-4-11(18)5-2-9/h1-8H,18H2,(H,20,21)/p-1