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

Systemtic Name: (1-hexoxy-1-oxidanylidene-heptan-2-yl)azanium; N-(1-hexoxy-1-oxidanylidene-heptan-2-yl)carbamate Openeye Name: 1-hexoxycarbonylhexylammonium; N-(1-hexoxycarbonylhexyl)carbamate CAS Name: (1-hexoxy-1-oxoheptan-2-yl)ammonium; N-(1-hexoxy-1-oxoheptan-2-yl)carbamate IUPAC Name: (1-hexoxy-1-oxoheptan-2-yl)azanium; N-(1-hexoxy-1-oxoheptan-2-yl)carbamate Traditional Name: 1-hexoxycarbonylhexylammonium; N-(1-hexoxycarbonylhexyl)carbamate Formula: C27H54N2O6 MolecularWeight: 502.72746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H27NO4.C13H27NO2/c1-3-5-7-9-11-19-13(16)12(15-14(17)18)10-8-6-4-2;1-3-5-7-9-11-16-13(15)12(14)10-8-6-4-2/h12,15H,3-11H2,1-2H3,(H,17,18);12H,3-11,14H2,1-2H3