[(E)-3-ethyl-1-oxidanyl-1-oxidanylidene-henicos-12-en-2-yl]-trimethyl-azanium

Systemtic Name: [(E)-3-ethyl-1-oxidanyl-1-oxidanylidene-henicos-12-en-2-yl]-trimethyl-azanium Openeye Name: [(E)-1-carboxy-2-ethyl-icos-11-enyl]-trimethyl-ammonium CAS Name: [(E)-3-ethyl-1-hydroxy-1-oxoheneicos-12-en-2-yl]-trimethylammonium IUPAC Name: [(E)-3-ethyl-1-hydroxy-1-oxohenicos-12-en-2-yl]-trimethylazanium Traditional Name: [(E)-1-carboxy-2-ethyl-eicos-11-enyl]-trimethyl-ammonium Formula: C26H52NO2+ MolecularWeight: 410.69658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCC(CC)C(C(=O)O)[N+](C)(C)C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCC(CC)C(C(=O)O)[N+](C)(C)C

InChI

InChI=1S/C26H51NO2/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(7-2)25(26(28)29)27(3,4)5/h14-15,24-25H,6-13,16-23H2,1-5H3/p+1/b15-14+