diethyl-[(2S)-3-[2-methoxy-4-[(oxan-4-ylazaniumyl)methyl]phenoxy]-2-oxidanyl-propyl]azanium

Systemtic Name: diethyl-[(2S)-3-[2-methoxy-4-[(oxan-4-ylazaniumyl)methyl]phenoxy]-2-oxidanyl-propyl]azanium Openeye Name: diethyl-[(2S)-2-hydroxy-3-[2-methoxy-4-[(tetrahydropyran-4-ylammonio)methyl]phenoxy]propyl]ammonium CAS Name: diethyl-[(2S)-2-hydroxy-3-[2-methoxy-4-[(4-oxanylammonio)methyl]phenoxy]propyl]ammonium IUPAC Name: diethyl-[(2S)-2-hydroxy-3-[2-methoxy-4-[(oxan-4-ylazaniumyl)methyl]phenoxy]propyl]azanium Traditional Name: diethyl-[(2S)-2-hydroxy-3-[2-methoxy-4-[(tetrahydropyran-4-ylammonio)methyl]phenoxy]propyl]ammonium Formula: C20H36N2O4+2 MolecularWeight: 368.51084

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC(COC1=C(C=C(C=C1)C[NH2+]C2CCOCC2)OC)O

Isomeric SMILES

CC[NH+](CC)C[C@@H](COC1=C(C=C(C=C1)C[NH2+]C2CCOCC2)OC)O

InChI

InChI=1S/C20H34N2O4/c1-4-22(5-2)14-18(23)15-26-19-7-6-16(12-20(19)24-3)13-21-17-8-10-25-11-9-17/h6-7,12,17-18,21,23H,4-5,8-11,13-15H2,1-3H3/p+2/t18-/m0/s1