3-(bromomethyl)-2-thiophen-3-yl-quinoline-4-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C(=N2)C3=CSC=C3)CBr)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C(=N2)C3=CSC=C3)CBr)C(=O)O

InChI

InChI=1S/C15H10BrNO2S/c16-7-11-13(15(18)19)10-3-1-2-4-12(10)17-14(11)9-5-6-20-8-9/h1-6,8H,7H2,(H,18,19)