[(2R)-2-hexanoyloxy-4-oxidanylidene-4-phenylmethoxy-butyl]-trimethyl-azanium

Systemtic Name: [(2R)-2-hexanoyloxy-4-oxidanylidene-4-phenylmethoxy-butyl]-trimethyl-azanium Openeye Name: [(2R)-4-benzyloxy-2-hexanoyloxy-4-oxo-butyl]-trimethyl-ammonium CAS Name: trimethyl-[(2R)-4-oxo-2-(1-oxohexoxy)-4-phenylmethoxybutyl]ammonium IUPAC Name: [(2R)-2-hexanoyloxy-4-oxo-4-phenylmethoxybutyl]-trimethylazanium Traditional Name: [(2R)-4-benzoxy-2-caproyloxy-4-keto-butyl]-trimethyl-ammonium Formula: C20H32NO4+ MolecularWeight: 350.47238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC(CC(=O)OCC1=CC=CC=C1)C[N+](C)(C)C

Isomeric SMILES

CCCCCC(=O)O[C@H](CC(=O)OCC1=CC=CC=C1)C[N+](C)(C)C

InChI

InChI=1S/C20H32NO4/c1-5-6-8-13-19(22)25-18(15-21(2,3)4)14-20(23)24-16-17-11-9-7-10-12-17/h7,9-12,18H,5-6,8,13-16H2,1-4H3/q+1/t18-/m1/s1