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

Systemtic Name: (5-methylfuran-2-yl)methyl-[[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-[(5-methyl-2-furyl)methyl]ammonium CAS Name: [3-[(2R)-2-hydroxy-3-(4-morpholin-4-iumyl)propoxy]phenyl]methyl-[(5-methyl-2-furanyl)methyl]ammonium IUPAC Name: [3-[(2R)-2-hydroxy-3-morpholin-4-ium-4-ylpropoxy]phenyl]methyl-[(5-methylfuran-2-yl)methyl]azanium Traditional Name: [3-[(2R)-2-hydroxy-3-morpholin-4-ium-4-yl-propoxy]benzyl]-[(5-methyl-2-furyl)methyl]ammonium Formula: C20H30N2O4+2 MolecularWeight: 362.4632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH2+]CC2=CC(=CC=C2)OCC(C[NH+]3CCOCC3)O

Isomeric SMILES

CC1=CC=C(O1)C[NH2+]CC2=CC(=CC=C2)OC[C@@H](C[NH+]3CCOCC3)O

InChI

InChI=1S/C20H28N2O4/c1-16-5-6-20(26-16)13-21-12-17-3-2-4-19(11-17)25-15-18(23)14-22-7-9-24-10-8-22/h2-6,11,18,21,23H,7-10,12-15H2,1H3/p+2/t18-/m1/s1