2-[2,5-bis(chloranyl)thiophen-3-yl]-6-tert-butyl-quinoline-4-carboxylic acid

Systemtic Name: 2-[2,5-bis(chloranyl)thiophen-3-yl]-6-tert-butyl-quinoline-4-carboxylic acid Openeye Name: 6-tert-butyl-2-(2,5-dichloro-3-thienyl)quinoline-4-carboxylic acid CAS Name: 6-tert-butyl-2-(2,5-dichloro-3-thiophenyl)-4-quinolinecarboxylic acid IUPAC Name: 6-tert-butyl-2-(2,5-dichlorothiophen-3-yl)quinoline-4-carboxylic acid Traditional Name: 6-tert-butyl-2-(2,5-dichloro-3-thienyl)cinchoninic acid Formula: C18H15Cl2NO2S MolecularWeight: 380.2882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=C(SC(=C3)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=C(SC(=C3)Cl)Cl

InChI

InChI=1S/C18H15Cl2NO2S/c1-18(2,3)9-4-5-13-10(6-9)11(17(22)23)7-14(21-13)12-8-15(19)24-16(12)20/h4-8H,1-3H3,(H,22,23)