8-bromanyl-2-(4-methoxy-2-methyl-phenyl)quinoline-4-carboxylic acid

Systemtic Name: 8-bromanyl-2-(4-methoxy-2-methyl-phenyl)quinoline-4-carboxylic acid Openeye Name: 8-bromo-2-(4-methoxy-2-methyl-phenyl)quinoline-4-carboxylic acid CAS Name: 8-bromo-2-(4-methoxy-2-methylphenyl)-4-quinolinecarboxylic acid IUPAC Name: 8-bromo-2-(4-methoxy-2-methylphenyl)quinoline-4-carboxylic acid Traditional Name: 8-bromo-2-(4-methoxy-2-methyl-phenyl)cinchoninic acid Formula: C18H14BrNO3 MolecularWeight: 372.21266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)C2=NC3=C(C=CC=C3Br)C(=C2)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)OC)C2=NC3=C(C=CC=C3Br)C(=C2)C(=O)O

InChI

InChI=1S/C18H14BrNO3/c1-10-8-11(23-2)6-7-12(10)16-9-14(18(21)22)13-4-3-5-15(19)17(13)20-16/h3-9H,1-2H3,(H,21,22)