3-[[(2R)-3-(4-ethanoylphenoxy)-2-oxidanyl-propyl]azaniumyl]propyl-diethyl-azanium

Systemtic Name: 3-[[(2R)-3-(4-ethanoylphenoxy)-2-oxidanyl-propyl]azaniumyl]propyl-diethyl-azanium Openeye Name: 3-[[(2R)-3-(4-acetylphenoxy)-2-hydroxy-propyl]ammonio]propyl-diethyl-ammonium CAS Name: 3-[[(2R)-3-(4-acetylphenoxy)-2-hydroxypropyl]ammonio]propyl-diethylammonium IUPAC Name: 3-[[(2R)-3-(4-acetylphenoxy)-2-hydroxypropyl]azaniumyl]propyl-diethylazanium Traditional Name: 3-[[(2R)-3-(4-acetylphenoxy)-2-hydroxy-propyl]ammonio]propyl-diethyl-ammonium Formula: C18H32N2O3+2 MolecularWeight: 324.45828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H30N2O3/c1-4-20(5-2)12-6-11-19-13-17(22)14-23-18-9-7-16(8-10-18)15(3)21/h7-10,17,19,22H,4-6,11-14H2,1-3H3/p+2/t17-/m1/s1