[1-(phenylmethyl)pyridin-1-ium-3-yl] morpholine-4-carboxylate

Systemtic Name: [1-(phenylmethyl)pyridin-1-ium-3-yl] morpholine-4-carboxylate Openeye Name: (1-benzylpyridin-1-ium-3-yl) morpholine-4-carboxylate CAS Name: 4-morpholinecarboxylic acid [1-(phenylmethyl)-3-pyridin-1-iumyl] ester IUPAC Name: (1-benzylpyridin-1-ium-3-yl) morpholine-4-carboxylate Traditional Name: morpholine-4-carboxylic acid (1-benzylpyridin-1-ium-3-yl) ester Formula: C17H19N2O3+ MolecularWeight: 299.34436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)OC2=C[N+](=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1COCCN1C(=O)OC2=C[N+](=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C17H19N2O3/c20-17(19-9-11-21-12-10-19)22-16-7-4-8-18(14-16)13-15-5-2-1-3-6-15/h1-8,14H,9-13H2/q+1