dimethyl-[(5-oxidanyl-4-oxidanylidene-pyran-2-yl)methyl]-tetradecyl-azanium

Systemtic Name: dimethyl-[(5-oxidanyl-4-oxidanylidene-pyran-2-yl)methyl]-tetradecyl-azanium Openeye Name: (5-hydroxy-4-oxo-pyran-2-yl)methyl-dimethyl-tetradecyl-ammonium CAS Name: (5-hydroxy-4-oxo-2-pyranyl)methyl-dimethyl-tetradecylammonium IUPAC Name: (5-hydroxy-4-oxopyran-2-yl)methyl-dimethyl-tetradecylazanium Traditional Name: (5-hydroxy-4-keto-pyran-2-yl)methyl-dimethyl-myristyl-ammonium Formula: C22H40NO3+ MolecularWeight: 366.5579

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC[N+](C)(C)CC1=CC(=O)C(=CO1)O

Isomeric SMILES

CCCCCCCCCCCCCC[N+](C)(C)CC1=CC(=O)C(=CO1)O

InChI

InChI=1S/C22H39NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-23(2,3)18-20-17-21(24)22(25)19-26-20/h17,19H,4-16,18H2,1-3H3/p+1