3-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]carbonyloxy]propyl-trimethyl-azanium

Systemtic Name: 3-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]carbonyloxy]propyl-trimethyl-azanium Openeye Name: 3-[(1S)-isochromane-1-carbonyl]oxypropyl-trimethyl-ammonium CAS Name: 3-[[(1S)-3,4-dihydro-1H-2-benzopyran-1-yl]-oxomethoxy]propyl-trimethylammonium IUPAC Name: 3-[(1S)-3,4-dihydro-1H-isochromene-1-carbonyl]oxypropyl-trimethylazanium Traditional Name: 3-[(1S)-isochroman-1-carbonyl]oxypropyl-trimethyl-ammonium Formula: C16H24NO3+ MolecularWeight: 278.36666

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCOC(=O)C1C2=CC=CC=C2CCO1

Isomeric SMILES

C[N+](C)(C)CCCOC(=O)[C@@H]1C2=CC=CC=C2CCO1

InChI

InChI=1S/C16H24NO3/c1-17(2,3)10-6-11-20-16(18)15-14-8-5-4-7-13(14)9-12-19-15/h4-5,7-8,15H,6,9-12H2,1-3H3/q+1/t15-/m0/s1