6-bromanyl-3,8-dimethyl-2-phenyl-quinoline-4-carboxylic acid

Systemtic Name: 6-bromanyl-3,8-dimethyl-2-phenyl-quinoline-4-carboxylic acid Openeye Name: 6-bromo-3,8-dimethyl-2-phenyl-quinoline-4-carboxylic acid CAS Name: 6-bromo-3,8-dimethyl-2-phenyl-4-quinolinecarboxylic acid IUPAC Name: 6-bromo-3,8-dimethyl-2-phenylquinoline-4-carboxylic acid Traditional Name: 6-bromo-3,8-dimethyl-2-phenyl-cinchoninic acid Formula: C18H14BrNO2 MolecularWeight: 356.21326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)Br)C(=C(C(=N2)C3=CC=CC=C3)C)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1)Br)C(=C(C(=N2)C3=CC=CC=C3)C)C(=O)O

InChI

InChI=1S/C18H14BrNO2/c1-10-8-13(19)9-14-15(18(21)22)11(2)17(20-16(10)14)12-6-4-3-5-7-12/h3-9H,1-2H3,(H,21,22)