diethyl-[(2S)-3-[2-methoxy-4-[[(1-methylimidazol-2-yl)methylazaniumyl]methyl]phenoxy]-2-oxidanyl-propyl]azanium

Systemtic Name: diethyl-[(2S)-3-[2-methoxy-4-[[(1-methylimidazol-2-yl)methylazaniumyl]methyl]phenoxy]-2-oxidanyl-propyl]azanium Openeye Name: diethyl-[(2S)-2-hydroxy-3-[2-methoxy-4-[[(1-methylimidazol-2-yl)methylammonio]methyl]phenoxy]propyl]ammonium CAS Name: diethyl-[(2S)-2-hydroxy-3-[2-methoxy-4-[[(1-methyl-2-imidazolyl)methylammonio]methyl]phenoxy]propyl]ammonium IUPAC Name: diethyl-[(2S)-2-hydroxy-3-[2-methoxy-4-[[(1-methylimidazol-2-yl)methylazaniumyl]methyl]phenoxy]propyl]azanium Traditional Name: diethyl-[(2S)-2-hydroxy-3-[2-methoxy-4-[[(1-methylimidazol-2-yl)methylammonio]methyl]phenoxy]propyl]ammonium Formula: C20H34N4O3+2 MolecularWeight: 378.50896

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC(COC1=C(C=C(C=C1)C[NH2+]CC2=NC=CN2C)OC)O

Isomeric SMILES

CC[NH+](CC)C[C@@H](COC1=C(C=C(C=C1)C[NH2+]CC2=NC=CN2C)OC)O

InChI

InChI=1S/C20H32N4O3/c1-5-24(6-2)14-17(25)15-27-18-8-7-16(11-19(18)26-4)12-21-13-20-22-9-10-23(20)3/h7-11,17,21,25H,5-6,12-15H2,1-4H3/p+2/t17-/m0/s1