butyl-diethyl-[2-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]oxy-propyl]azanium

Systemtic Name: butyl-diethyl-[2-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]oxy-propyl]azanium Openeye Name: butyl-diethyl-[2-hydroxy-3-[(E)-3-phenylprop-2-enoyl]oxy-propyl]ammonium CAS Name: butyl-diethyl-[2-hydroxy-3-[(E)-1-oxo-3-phenylprop-2-enoxy]propyl]ammonium IUPAC Name: butyl-diethyl-[2-hydroxy-3-[(E)-3-phenylprop-2-enoyl]oxypropyl]azanium Traditional Name: butyl-diethyl-[2-hydroxy-3-[(E)-3-phenylacryloyl]oxy-propyl]ammonium Formula: C20H32NO3+ MolecularWeight: 334.47298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CC)(CC)CC(COC(=O)C=CC1=CC=CC=C1)O

Isomeric SMILES

CCCC[N+](CC)(CC)CC(COC(=O)/C=C/C1=CC=CC=C1)O

InChI

InChI=1S/C20H32NO3/c1-4-7-15-21(5-2,6-3)16-19(22)17-24-20(23)14-13-18-11-9-8-10-12-18/h8-14,19,22H,4-7,15-17H2,1-3H3/q+1/b14-13+