6-bromanyl-3-methyl-2-thiophen-2-yl-quinoline-4-carboxylic acid

Systemtic Name: 6-bromanyl-3-methyl-2-thiophen-2-yl-quinoline-4-carboxylic acid Openeye Name: 6-bromo-3-methyl-2-(2-thienyl)quinoline-4-carboxylic acid CAS Name: 6-bromo-3-methyl-2-thiophen-2-yl-4-quinolinecarboxylic acid IUPAC Name: 6-bromo-3-methyl-2-thiophen-2-ylquinoline-4-carboxylic acid Traditional Name: 6-bromo-3-methyl-2-(2-thienyl)cinchoninic acid Formula: C15H10BrNO2S MolecularWeight: 348.2144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1C(=O)O)Br)C3=CC=CS3

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1C(=O)O)Br)C3=CC=CS3

InChI

InChI=1S/C15H10BrNO2S/c1-8-13(15(18)19)10-7-9(16)4-5-11(10)17-14(8)12-3-2-6-20-12/h2-7H,1H3,(H,18,19)