2-cyclohexyl-5,7-dimethyl-quinoline-4-carboxylic acid

Systemtic Name: 2-cyclohexyl-5,7-dimethyl-quinoline-4-carboxylic acid Openeye Name: 2-cyclohexyl-5,7-dimethyl-quinoline-4-carboxylic acid CAS Name: 2-cyclohexyl-5,7-dimethyl-4-quinolinecarboxylic acid IUPAC Name: 2-cyclohexyl-5,7-dimethylquinoline-4-carboxylic acid Traditional Name: 2-cyclohexyl-5,7-dimethyl-cinchoninic acid Formula: C18H21NO2 MolecularWeight: 283.36484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=CC(=NC2=C1)C3CCCCC3)C(=O)O)C

Isomeric SMILES

CC1=CC(=C2C(=CC(=NC2=C1)C3CCCCC3)C(=O)O)C

InChI

InChI=1S/C18H21NO2/c1-11-8-12(2)17-14(18(20)21)10-15(19-16(17)9-11)13-6-4-3-5-7-13/h8-10,13H,3-7H2,1-2H3,(H,20,21)