[(E)-2,14-bis(oxidanyl)-3-oxidanylidene-icos-14-enyl]-trimethyl-azanium

Systemtic Name: [(E)-2,14-bis(oxidanyl)-3-oxidanylidene-icos-14-enyl]-trimethyl-azanium Openeye Name: [(E)-2,14-dihydroxy-3-oxo-icos-14-enyl]-trimethyl-ammonium CAS Name: [(E)-2,14-dihydroxy-3-oxoeicos-14-enyl]-trimethylammonium IUPAC Name: [(E)-2,14-dihydroxy-3-oxoicos-14-enyl]-trimethylazanium Traditional Name: [(E)-2,14-dihydroxy-3-keto-eicos-14-enyl]-trimethyl-ammonium Formula: C23H46NO3+ MolecularWeight: 384.61624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=C(CCCCCCCCCCC(=O)C(C[N+](C)(C)C)O)O

Isomeric SMILES

CCCCC/C=C(\CCCCCCCCCCC(=O)C(C[N+](C)(C)C)O)/O

InChI

InChI=1S/C23H45NO3/c1-5-6-7-14-17-21(25)18-15-12-10-8-9-11-13-16-19-22(26)23(27)20-24(2,3)4/h17,23,27H,5-16,18-20H2,1-4H3/p+1/b21-17+