3-phenylpropyl 2-(4-methylmorpholin-4-ium-4-yl)ethanoate

Systemtic Name: 3-phenylpropyl 2-(4-methylmorpholin-4-ium-4-yl)ethanoate Openeye Name: 3-phenylpropyl 2-(4-methylmorpholin-4-ium-4-yl)acetate CAS Name: 2-(4-methyl-4-morpholin-4-iumyl)acetic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 2-(4-methylmorpholin-4-ium-4-yl)acetate Traditional Name: 2-(4-methylmorpholin-4-ium-4-yl)acetic acid 3-phenylpropyl ester Formula: C16H24NO3+ MolecularWeight: 278.36666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOCC1)CC(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

C[N+]1(CCOCC1)CC(=O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C16H24NO3/c1-17(9-12-19-13-10-17)14-16(18)20-11-5-8-15-6-3-2-4-7-15/h2-4,6-7H,5,8-14H2,1H3/q+1