[(2R)-1-piperidin-1-ium-1-ylpropan-2-yl] (E)-3-(furan-2-yl)prop-2-enoate

Systemtic Name: [(2R)-1-piperidin-1-ium-1-ylpropan-2-yl] (E)-3-(furan-2-yl)prop-2-enoate Openeye Name: [(1R)-1-methyl-2-piperidin-1-ium-1-yl-ethyl] (E)-3-(2-furyl)prop-2-enoate CAS Name: (E)-3-(2-furanyl)-2-propenoic acid [(2R)-1-(1-piperidin-1-iumyl)propan-2-yl] ester IUPAC Name: [(2R)-1-piperidin-1-ium-1-ylpropan-2-yl] (E)-3-(furan-2-yl)prop-2-enoate Traditional Name: (E)-3-(2-furyl)acrylic acid [(1R)-1-methyl-2-piperidin-1-ium-1-yl-ethyl] ester Formula: C15H22NO3+ MolecularWeight: 264.34008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCCCC1)OC(=O)C=CC2=CC=CO2

Isomeric SMILES

C[C@H](C[NH+]1CCCCC1)OC(=O)/C=C/C2=CC=CO2

InChI

InChI=1S/C15H21NO3/c1-13(12-16-9-3-2-4-10-16)19-15(17)8-7-14-6-5-11-18-14/h5-8,11,13H,2-4,9-10,12H2,1H3/p+1/b8-7+/t13-/m1/s1