4-[(2,2,4-trimethyl-7-oxidanyl-quinolin-1-yl)methyl]benzoic acid

Systemtic Name: 4-[(2,2,4-trimethyl-7-oxidanyl-quinolin-1-yl)methyl]benzoic acid Openeye Name: 4-[(7-hydroxy-2,2,4-trimethyl-1-quinolyl)methyl]benzoic acid CAS Name: 4-[(7-hydroxy-2,2,4-trimethyl-1-quinolinyl)methyl]benzoic acid IUPAC Name: 4-[(7-hydroxy-2,2,4-trimethylquinolin-1-yl)methyl]benzoic acid Traditional Name: 4-[(7-hydroxy-2,2,4-trimethyl-1-quinolyl)methyl]benzoic acid Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(C2=C1C=CC(=C2)O)CC3=CC=C(C=C3)C(=O)O)(C)C

Isomeric SMILES

CC1=CC(N(C2=C1C=CC(=C2)O)CC3=CC=C(C=C3)C(=O)O)(C)C

InChI

InChI=1S/C20H21NO3/c1-13-11-20(2,3)21(18-10-16(22)8-9-17(13)18)12-14-4-6-15(7-5-14)19(23)24/h4-11,22H,12H2,1-3H3,(H,23,24)