2-[[(2R)-3-(4-ethanoylphenoxy)-2-oxidanyl-propyl]azaniumyl]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[(2R)-3-(4-ethanoylphenoxy)-2-oxidanyl-propyl]azaniumyl]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[(2R)-3-(4-acetylphenoxy)-2-hydroxy-propyl]ammonio]ethyl-diisopropyl-ammonium CAS Name: 2-[[(2R)-3-(4-acetylphenoxy)-2-hydroxypropyl]ammonio]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[(2R)-3-(4-acetylphenoxy)-2-hydroxypropyl]azaniumyl]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[(2R)-3-(4-acetylphenoxy)-2-hydroxy-propyl]ammonio]ethyl-diisopropyl-ammonium Formula: C19H34N2O3+2 MolecularWeight: 338.48486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H32N2O3/c1-14(2)21(15(3)4)11-10-20-12-18(23)13-24-19-8-6-17(7-9-19)16(5)22/h6-9,14-15,18,20,23H,10-13H2,1-5H3/p+2/t18-/m1/s1