3-morpholin-4-ium-4-ylpropyl-[(2,4,5-trimethoxyphenyl)methyl]azanium

Systemtic Name: 3-morpholin-4-ium-4-ylpropyl-[(2,4,5-trimethoxyphenyl)methyl]azanium Openeye Name: 3-morpholin-4-ium-4-ylpropyl-[(2,4,5-trimethoxyphenyl)methyl]ammonium CAS Name: 3-(4-morpholin-4-iumyl)propyl-[(2,4,5-trimethoxyphenyl)methyl]ammonium IUPAC Name: 3-morpholin-4-ium-4-ylpropyl-[(2,4,5-trimethoxyphenyl)methyl]azanium Traditional Name: 3-morpholin-4-ium-4-ylpropyl-(2,4,5-trimethoxybenzyl)ammonium Formula: C17H30N2O4+2 MolecularWeight: 326.4311

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C[NH2+]CCC[NH+]2CCOCC2)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C[NH2+]CCC[NH+]2CCOCC2)OC)OC

InChI

InChI=1S/C17H28N2O4/c1-20-15-12-17(22-3)16(21-2)11-14(15)13-18-5-4-6-19-7-9-23-10-8-19/h11-12,18H,4-10,13H2,1-3H3/p+2