5-(2,2-dimethylpropyl)-2-phenyl-1,3-oxazole-4-carboxylate

Systemtic Name: 5-(2,2-dimethylpropyl)-2-phenyl-1,3-oxazole-4-carboxylate Openeye Name: 5-(2,2-dimethylpropyl)-2-phenyl-oxazole-4-carboxylate CAS Name: 5-(2,2-dimethylpropyl)-2-phenyl-4-oxazolecarboxylate IUPAC Name: 5-(2,2-dimethylpropyl)-2-phenyl-1,3-oxazole-4-carboxylate Traditional Name: 5-neopentyl-2-phenyl-oxazole-4-carboxylate Formula: C15H16NO3- MolecularWeight: 258.29244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=C(N=C(O1)C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC(C)(C)CC1=C(N=C(O1)C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C15H17NO3/c1-15(2,3)9-11-12(14(17)18)16-13(19-11)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3,(H,17,18)/p-1