6-bromanyl-3-(diethylamino)-2-phenyl-quinoline-4-carboxylic acid

Systemtic Name: 6-bromanyl-3-(diethylamino)-2-phenyl-quinoline-4-carboxylic acid Openeye Name: 6-bromo-3-(diethylamino)-2-phenyl-quinoline-4-carboxylic acid CAS Name: 6-bromo-3-(diethylamino)-2-phenyl-4-quinolinecarboxylic acid IUPAC Name: 6-bromo-3-(diethylamino)-2-phenylquinoline-4-carboxylic acid Traditional Name: 6-bromo-3-(diethylamino)-2-phenyl-cinchoninic acid Formula: C20H19BrN2O2 MolecularWeight: 399.28106

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(N=C2C=CC(=CC2=C1C(=O)O)Br)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C1=C(N=C2C=CC(=CC2=C1C(=O)O)Br)C3=CC=CC=C3

InChI

InChI=1S/C20H19BrN2O2/c1-3-23(4-2)19-17(20(24)25)15-12-14(21)10-11-16(15)22-18(19)13-8-6-5-7-9-13/h5-12H,3-4H2,1-2H3,(H,24,25)