3-methyl-5-phenethyl-2H-1,3-oxazole-4-carboxylic acid

Systemtic Name: 3-methyl-5-phenethyl-2H-1,3-oxazole-4-carboxylic acid Openeye Name: 3-methyl-5-phenethyl-2H-oxazole-4-carboxylic acid CAS Name: 3-methyl-5-phenethyl-2H-oxazole-4-carboxylic acid IUPAC Name: 3-methyl-5-phenethyl-2H-1,3-oxazole-4-carboxylic acid Traditional Name: 3-methyl-5-phenethyl-4-oxazoline-4-carboxylic acid Formula: C13H15NO3 MolecularWeight: 233.2631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1COC(=C1C(=O)O)CCC2=CC=CC=C2

Isomeric SMILES

CN1COC(=C1C(=O)O)CCC2=CC=CC=C2

InChI

InChI=1S/C13H15NO3/c1-14-9-17-11(12(14)13(15)16)8-7-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,15,16)