2-(1-ethyl-2,2,4-trimethyl-7-oxidanyl-quinolin-6-yl)carbonylbenzoic acid

Systemtic Name: 2-(1-ethyl-2,2,4-trimethyl-7-oxidanyl-quinolin-6-yl)carbonylbenzoic acid Openeye Name: 2-(1-ethyl-7-hydroxy-2,2,4-trimethyl-quinoline-6-carbonyl)benzoic acid CAS Name: 2-[(1-ethyl-7-hydroxy-2,2,4-trimethyl-6-quinolinyl)-oxomethyl]benzoic acid IUPAC Name: 2-(1-ethyl-7-hydroxy-2,2,4-trimethylquinoline-6-carbonyl)benzoic acid Traditional Name: 2-(1-ethyl-7-hydroxy-2,2,4-trimethyl-quinoline-6-carbonyl)benzoic acid Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC(=C(C=C2C(=CC1(C)C)C)C(=O)C3=CC=CC=C3C(=O)O)O

Isomeric SMILES

CCN1C2=CC(=C(C=C2C(=CC1(C)C)C)C(=O)C3=CC=CC=C3C(=O)O)O

InChI

InChI=1S/C22H23NO4/c1-5-23-18-11-19(24)17(10-16(18)13(2)12-22(23,3)4)20(25)14-8-6-7-9-15(14)21(26)27/h6-12,24H,5H2,1-4H3,(H,26,27)