3,4,4-trimethyl-2-phenethyl-5H-1,3-oxazol-3-ium

Systemtic Name: 3,4,4-trimethyl-2-phenethyl-5H-1,3-oxazol-3-ium Openeye Name: 3,4,4-trimethyl-2-phenethyl-5H-oxazol-3-ium CAS Name: 3,4,4-trimethyl-2-phenethyl-5H-oxazol-3-ium IUPAC Name: 3,4,4-trimethyl-2-phenethyl-5H-1,3-oxazol-3-ium Traditional Name: 3,4,4-trimethyl-2-phenethyl-2-oxazolin-3-ium Formula: C14H20NO+ MolecularWeight: 218.3147

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(=[N+]1C)CCC2=CC=CC=C2)C

Isomeric SMILES

CC1(COC(=[N+]1C)CCC2=CC=CC=C2)C

InChI

InChI=1S/C14H20NO/c1-14(2)11-16-13(15(14)3)10-9-12-7-5-4-6-8-12/h4-8H,9-11H2,1-3H3/q+1