1-[[2-(2,4-dimethylphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[[2-(2,4-dimethylphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[[2-(2,4-dimethylphenyl)-5-methyl-oxazol-4-yl]methyl]piperidine-4-carboxylic acid CAS Name: 1-[[2-(2,4-dimethylphenyl)-5-methyl-4-oxazolyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[[2-(2,4-dimethylphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxylic acid Traditional Name: 1-[[2-(2,4-dimethylphenyl)-5-methyl-oxazol-4-yl]methyl]isonipecotic acid Formula: C19H24N2O3 MolecularWeight: 328.40546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC(=C(O2)C)CN3CCC(CC3)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC(=C(O2)C)CN3CCC(CC3)C(=O)O)C

InChI

InChI=1S/C19H24N2O3/c1-12-4-5-16(13(2)10-12)18-20-17(14(3)24-18)11-21-8-6-15(7-9-21)19(22)23/h4-5,10,15H,6-9,11H2,1-3H3,(H,22,23)