[2-(2-acetyloxyethyl)-3-(3-acetyloxypropyl)phenyl]azanium ethanoate

Systemtic Name: [2-(2-acetyloxyethyl)-3-(3-acetyloxypropyl)phenyl]azanium ethanoate Openeye Name: [2-(2-acetoxyethyl)-3-(3-acetoxypropyl)phenyl]ammonium acetate CAS Name: [2-(2-acetyloxyethyl)-3-(3-acetyloxypropyl)phenyl]ammonium acetate IUPAC Name: [2-(2-acetyloxyethyl)-3-(3-acetyloxypropyl)phenyl]azanium acetate Traditional Name: [2-(2-acetoxyethyl)-3-(3-acetoxypropyl)phenyl]ammonium acetate Formula: C17H25NO6 MolecularWeight: 339.3835

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].CC(=O)OCCCC1=C(C(=CC=C1)[NH3+])CCOC(=O)C

Isomeric SMILES

CC(=O)[O-].CC(=O)OCCCC1=C(C(=CC=C1)[NH3+])CCOC(=O)C

InChI

InChI=1S/C15H21NO4.C2H4O2/c1-11(17)19-9-4-6-13-5-3-7-15(16)14(13)8-10-20-12(2)18;1-2(3)4/h3,5,7H,4,6,8-10,16H2,1-2H3;1H3,(H,3,4)