3-(4-butoxy-2-oxidanyl-phenyl)carbonyloxypropyl-diethyl-azanium

Systemtic Name: 3-(4-butoxy-2-oxidanyl-phenyl)carbonyloxypropyl-diethyl-azanium Openeye Name: 3-(4-butoxy-2-hydroxy-benzoyl)oxypropyl-diethyl-ammonium CAS Name: 3-[(4-butoxy-2-hydroxyphenyl)-oxomethoxy]propyl-diethylammonium IUPAC Name: 3-(4-butoxy-2-hydroxybenzoyl)oxypropyl-diethylazanium Traditional Name: 3-(4-butoxy-2-hydroxy-benzoyl)oxypropyl-diethyl-ammonium Formula: C18H30NO4+ MolecularWeight: 324.4351

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C=C1)C(=O)OCCC[NH+](CC)CC)O

Isomeric SMILES

CCCCOC1=CC(=C(C=C1)C(=O)OCCC[NH+](CC)CC)O

InChI

InChI=1S/C18H29NO4/c1-4-7-12-22-15-9-10-16(17(20)14-15)18(21)23-13-8-11-19(5-2)6-3/h9-10,14,20H,4-8,11-13H2,1-3H3/p+1