3-methyl-2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]carbonylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 3-methyl-2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]carbonylamino]cyclohexane-1-carboxylic acid Openeye Name: 3-methyl-2-[[4-[(2-methyl-4-quinolyl)methoxy]benzoyl]amino]cyclohexanecarboxylic acid CAS Name: 3-methyl-2-[[[4-[(2-methyl-4-quinolinyl)methoxy]phenyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 3-methyl-2-[[4-[(2-methylquinolin-4-yl)methoxy]benzoyl]amino]cyclohexane-1-carboxylic acid Traditional Name: 3-methyl-2-[[4-[(2-methyl-4-quinolyl)methoxy]benzoyl]amino]cyclohexanecarboxylic acid Formula: C26H28N2O4 MolecularWeight: 432.51152

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1NC(=O)C2=CC=C(C=C2)OCC3=CC(=NC4=CC=CC=C43)C)C(=O)O

Isomeric SMILES

CC1CCCC(C1NC(=O)C2=CC=C(C=C2)OCC3=CC(=NC4=CC=CC=C43)C)C(=O)O

InChI

InChI=1S/C26H28N2O4/c1-16-6-5-8-22(26(30)31)24(16)28-25(29)18-10-12-20(13-11-18)32-15-19-14-17(2)27-23-9-4-3-7-21(19)23/h3-4,7,9-14,16,22,24H,5-6,8,15H2,1-2H3,(H,28,29)(H,30,31)