(1-methyl-1-oxidanidyl-piperidin-1-ium-4-yl) 2,2-diphenyl-2-propoxy-ethanoate

Systemtic Name: (1-methyl-1-oxidanidyl-piperidin-1-ium-4-yl) 2,2-diphenyl-2-propoxy-ethanoate Openeye Name: (1-methyl-1-oxido-piperidin-1-ium-4-yl) 2,2-diphenyl-2-propoxy-acetate CAS Name: 2,2-diphenyl-2-propoxyacetic acid (1-methyl-1-oxido-4-piperidin-1-iumyl) ester IUPAC Name: (1-methyl-1-oxidopiperidin-1-ium-4-yl) 2,2-diphenyl-2-propoxyacetate Traditional Name: 2,2-diphenyl-2-propoxy-acetic acid (1-methyl-1-oxido-piperidin-1-ium-4-yl) ester Formula: C23H29NO4 MolecularWeight: 383.48066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OC3CC[N+](CC3)(C)[O-]

Isomeric SMILES

CCCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OC3CC[N+](CC3)(C)[O-]

InChI

InChI=1S/C23H29NO4/c1-3-18-27-23(19-10-6-4-7-11-19,20-12-8-5-9-13-20)22(25)28-21-14-16-24(2,26)17-15-21/h4-13,21H,3,14-18H2,1-2H3