[2-(2-butylphenyl)carbonyloxy-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium

Systemtic Name: [2-(2-butylphenyl)carbonyloxy-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium Openeye Name: [2-(2-butylbenzoyl)oxy-4-hydroxy-4-oxo-butyl]-trimethyl-ammonium CAS Name: [2-[(2-butylphenyl)-oxomethoxy]-4-hydroxy-4-oxobutyl]-trimethylammonium IUPAC Name: [2-(2-butylbenzoyl)oxy-4-hydroxy-4-oxobutyl]-trimethylazanium Traditional Name: [2-(2-butylbenzoyl)oxy-4-hydroxy-4-keto-butyl]-trimethyl-ammonium Formula: C18H28NO4+ MolecularWeight: 322.41922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC=C1C(=O)OC(CC(=O)O)C[N+](C)(C)C

Isomeric SMILES

CCCCC1=CC=CC=C1C(=O)OC(CC(=O)O)C[N+](C)(C)C

InChI

InChI=1S/C18H27NO4/c1-5-6-9-14-10-7-8-11-16(14)18(22)23-15(12-17(20)21)13-19(2,3)4/h7-8,10-11,15H,5-6,9,12-13H2,1-4H3/p+1