2-methylprop-2-enyl-[[3-[(2R)-3-morpholin-4-ium-4-yl-2-oxidanyl-propoxy]phenyl]methyl]azanium

Systemtic Name: 2-methylprop-2-enyl-[[3-[(2R)-3-morpholin-4-ium-4-yl-2-oxidanyl-propoxy]phenyl]methyl]azanium Openeye Name: [3-[(2R)-2-hydroxy-3-morpholin-4-ium-4-yl-propoxy]phenyl]methyl-(2-methylallyl)ammonium CAS Name: [3-[(2R)-2-hydroxy-3-(4-morpholin-4-iumyl)propoxy]phenyl]methyl-(2-methylprop-2-enyl)ammonium IUPAC Name: [3-[(2R)-2-hydroxy-3-morpholin-4-ium-4-ylpropoxy]phenyl]methyl-(2-methylprop-2-enyl)azanium Traditional Name: [3-[(2R)-2-hydroxy-3-morpholin-4-ium-4-yl-propoxy]benzyl]-(2-methylallyl)ammonium Formula: C18H30N2O3+2 MolecularWeight: 322.4424

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C[NH2+]CC1=CC(=CC=C1)OCC(C[NH+]2CCOCC2)O

Isomeric SMILES

CC(=C)C[NH2+]CC1=CC(=CC=C1)OC[C@@H](C[NH+]2CCOCC2)O

InChI

InChI=1S/C18H28N2O3/c1-15(2)11-19-12-16-4-3-5-18(10-16)23-14-17(21)13-20-6-8-22-9-7-20/h3-5,10,17,19,21H,1,6-9,11-14H2,2H3/p+2/t17-/m1/s1