2-tert-butyl-6-chloranyl-quinoline-4-carboxylic acid

Systemtic Name: 2-tert-butyl-6-chloranyl-quinoline-4-carboxylic acid Openeye Name: 2-tert-butyl-6-chloro-quinoline-4-carboxylic acid CAS Name: 2-tert-butyl-6-chloro-4-quinolinecarboxylic acid IUPAC Name: 2-tert-butyl-6-chloroquinoline-4-carboxylic acid Traditional Name: 2-tert-butyl-6-chloro-cinchoninic acid Formula: C14H14ClNO2 MolecularWeight: 263.71946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(C=C(C=C2)Cl)C(=C1)C(=O)O

Isomeric SMILES

CC(C)(C)C1=NC2=C(C=C(C=C2)Cl)C(=C1)C(=O)O

InChI

InChI=1S/C14H14ClNO2/c1-14(2,3)12-7-10(13(17)18)9-6-8(15)4-5-11(9)16-12/h4-7H,1-3H3,(H,17,18)