8-ethyl-2-[1-(2-methylphenyl)cyclopropyl]-3-oxidanyl-quinoline-4-carboxylic acid

Systemtic Name: 8-ethyl-2-[1-(2-methylphenyl)cyclopropyl]-3-oxidanyl-quinoline-4-carboxylic acid Openeye Name: 8-ethyl-3-hydroxy-2-[1-(o-tolyl)cyclopropyl]quinoline-4-carboxylic acid CAS Name: 8-ethyl-3-hydroxy-2-[1-(2-methylphenyl)cyclopropyl]-4-quinolinecarboxylic acid IUPAC Name: 8-ethyl-3-hydroxy-2-[1-(2-methylphenyl)cyclopropyl]quinoline-4-carboxylic acid Traditional Name: 8-ethyl-3-hydroxy-2-[1-(o-tolyl)cyclopropyl]cinchoninic acid Formula: C22H21NO3 MolecularWeight: 347.40704

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C(C(=C(N=C21)C3(CC3)C4=CC=CC=C4C)O)C(=O)O

Isomeric SMILES

CCC1=CC=CC2=C(C(=C(N=C21)C3(CC3)C4=CC=CC=C4C)O)C(=O)O

InChI

InChI=1S/C22H21NO3/c1-3-14-8-6-9-15-17(21(25)26)19(24)20(23-18(14)15)22(11-12-22)16-10-5-4-7-13(16)2/h4-10,24H,3,11-12H2,1-2H3,(H,25,26)