6-bromanyl-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylic acid

Systemtic Name: 6-bromanyl-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylic acid Openeye Name: 6-bromo-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylic acid CAS Name: 6-bromo-2-(4-methoxyphenyl)-3-methyl-4-quinolinecarboxylic acid IUPAC Name: 6-bromo-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxylic acid Traditional Name: 6-bromo-2-(4-methoxyphenyl)-3-methyl-cinchoninic acid Formula: C18H14BrNO3 MolecularWeight: 372.21266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1C(=O)O)Br)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1C(=O)O)Br)C3=CC=C(C=C3)OC

InChI

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