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

Systemtic Name: 1-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[[5-methyl-2-(p-tolyl)oxazol-4-yl]methyl]piperidine-4-carboxylic acid CAS Name: 1-[[5-methyl-2-(4-methylphenyl)-4-oxazolyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl]piperidine-4-carboxylic acid Traditional Name: 1-[[5-methyl-2-(p-tolyl)oxazol-4-yl]methyl]isonipecotic acid Formula: C18H22N2O3 MolecularWeight: 314.37888

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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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O3/c1-12-3-5-14(6-4-12)17-19-16(13(2)23-17)11-20-9-7-15(8-10-20)18(21)22/h3-6,15H,7-11H2,1-2H3,(H,21,22)