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

Systemtic Name: (1-dodecoxy-1-oxidanylidene-heptan-2-yl)azanium; N-(1-dodecoxy-1-oxidanylidene-heptan-2-yl)carbamate Openeye Name: 1-dodecoxycarbonylhexylammonium; N-(1-dodecoxycarbonylhexyl)carbamate CAS Name: (1-dodecoxy-1-oxoheptan-2-yl)ammonium; N-(1-dodecoxy-1-oxoheptan-2-yl)carbamate IUPAC Name: (1-dodecoxy-1-oxoheptan-2-yl)azanium; N-(1-dodecoxy-1-oxoheptan-2-yl)carbamate Traditional Name: 1-lauryloxycarbonylhexylammonium; N-(1-lauryloxycarbonylhexyl)carbamate Formula: C39H78N2O6 MolecularWeight: 671.04642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H39NO4.C19H39NO2/c1-3-5-7-8-9-10-11-12-13-15-17-25-19(22)18(21-20(23)24)16-14-6-4-2;1-3-5-7-8-9-10-11-12-13-15-17-22-19(21)18(20)16-14-6-4-2/h18,21H,3-17H2,1-2H3,(H,23,24);18H,3-17,20H2,1-2H3