methyl 4-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]benzoate

Systemtic Name: methyl 4-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]benzoate Openeye Name: methyl 4-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]benzoate CAS Name: 4-[[(2R,6R)-2,6-dimethyl-4-morpholin-4-iumyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]benzoate Traditional Name: 4-[[(2R,6R)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]benzoic acid methyl ester Formula: C15H22NO3+ MolecularWeight: 264.34008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)CC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

C[C@@H]1C[NH+](C[C@H](O1)C)CC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C15H21NO3/c1-11-8-16(9-12(2)19-11)10-13-4-6-14(7-5-13)15(17)18-3/h4-7,11-12H,8-10H2,1-3H3/p+1/t11-,12-/m1/s1