(1-methyl-1-oxidanidyl-pyrrolidin-1-ium-3-yl)methyl but-2-enoate

Systemtic Name: (1-methyl-1-oxidanidyl-pyrrolidin-1-ium-3-yl)methyl but-2-enoate Openeye Name: (1-methyl-1-oxido-pyrrolidin-1-ium-3-yl)methyl but-2-enoate CAS Name: 2-butenoic acid (1-methyl-1-oxido-3-pyrrolidin-1-iumyl)methyl ester IUPAC Name: (1-methyl-1-oxidopyrrolidin-1-ium-3-yl)methyl but-2-enoate Traditional Name: but-2-enoic acid (1-methyl-1-oxido-pyrrolidin-1-ium-3-yl)methyl ester Formula: C10H17NO3 MolecularWeight: 199.24688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)OCC1CC[N+](C1)(C)[O-]

Isomeric SMILES

CC=CC(=O)OCC1CC[N+](C1)(C)[O-]

InChI

InChI=1S/C10H17NO3/c1-3-4-10(12)14-8-9-5-6-11(2,13)7-9/h3-4,9H,5-8H2,1-2H3