[(E)-2-methyl-4-oxidanylidene-henicos-12-en-2-yl]azanium

Systemtic Name: [(E)-2-methyl-4-oxidanylidene-henicos-12-en-2-yl]azanium Openeye Name: [(E)-1,1-dimethyl-3-oxo-icos-11-enyl]ammonium CAS Name: [(E)-2-methyl-4-oxoheneicos-12-en-2-yl]ammonium IUPAC Name: [(E)-2-methyl-4-oxohenicos-12-en-2-yl]azanium Traditional Name: [(E)-3-keto-1,1-dimethyl-eicos-11-enyl]ammonium Formula: C22H44NO+ MolecularWeight: 338.59086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)CC(C)(C)[NH3+]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)CC(C)(C)[NH3+]

InChI

InChI=1S/C22H43NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(24)20-22(2,3)23/h11-12H,4-10,13-20,23H2,1-3H3/p+1/b12-11+