(1-oxidanylidene-1-tetradecoxy-heptan-2-yl)azanium; N-(1-oxidanylidene-1-tetradecoxy-heptan-2-yl)carbamate

Systemtic Name: (1-oxidanylidene-1-tetradecoxy-heptan-2-yl)azanium; N-(1-oxidanylidene-1-tetradecoxy-heptan-2-yl)carbamate Openeye Name: 1-tetradecoxycarbonylhexylammonium; N-(1-tetradecoxycarbonylhexyl)carbamate CAS Name: (1-oxo-1-tetradecoxyheptan-2-yl)ammonium; N-(1-oxo-1-tetradecoxyheptan-2-yl)carbamate IUPAC Name: (1-oxo-1-tetradecoxyheptan-2-yl)azanium; N-(1-oxo-1-tetradecoxyheptan-2-yl)carbamate Traditional Name: 1-myristyloxycarbonylhexylammonium; N-(1-myristyloxycarbonylhexyl)carbamate Formula: C43H86N2O6 MolecularWeight: 727.15274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(=O)C(CCCCC)[NH3+].CCCCCCCCCCCCCCOC(=O)C(CCCCC)NC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCOC(=O)C(CCCCC)[NH3+].CCCCCCCCCCCCCCOC(=O)C(CCCCC)NC(=O)[O-]

InChI

InChI=1S/C22H43NO4.C21H43NO2/c1-3-5-7-8-9-10-11-12-13-14-15-17-19-27-21(24)20(23-22(25)26)18-16-6-4-2;1-3-5-7-8-9-10-11-12-13-14-15-17-19-24-21(23)20(22)18-16-6-4-2/h20,23H,3-19H2,1-2H3,(H,25,26);20H,3-19,22H2,1-2H3