6-chloranyl-3-ethyl-2-propyl-quinoline-4-carboxylic acid

Systemtic Name: 6-chloranyl-3-ethyl-2-propyl-quinoline-4-carboxylic acid Openeye Name: 6-chloro-3-ethyl-2-propyl-quinoline-4-carboxylic acid CAS Name: 6-chloro-3-ethyl-2-propyl-4-quinolinecarboxylic acid IUPAC Name: 6-chloro-3-ethyl-2-propylquinoline-4-carboxylic acid Traditional Name: 6-chloro-3-ethyl-2-propyl-cinchoninic acid Formula: C15H16ClNO2 MolecularWeight: 277.74604

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C2C=C(C=CC2=N1)Cl)C(=O)O)CC

Isomeric SMILES

CCCC1=C(C(=C2C=C(C=CC2=N1)Cl)C(=O)O)CC

InChI

InChI=1S/C15H16ClNO2/c1-3-5-12-10(4-2)14(15(18)19)11-8-9(16)6-7-13(11)17-12/h6-8H,3-5H2,1-2H3,(H,18,19)