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

Systemtic Name: (1-decoxy-1-oxidanylidene-heptan-2-yl)azanium; N-(1-decoxy-1-oxidanylidene-heptan-2-yl)carbamate Openeye Name: 1-decoxycarbonylhexylammonium; N-(1-decoxycarbonylhexyl)carbamate CAS Name: (1-decoxy-1-oxoheptan-2-yl)ammonium; N-(1-decoxy-1-oxoheptan-2-yl)carbamate IUPAC Name: (1-decoxy-1-oxoheptan-2-yl)azanium; N-(1-decoxy-1-oxoheptan-2-yl)carbamate Traditional Name: 1-decoxycarbonylhexylammonium; N-(1-decoxycarbonylhexyl)carbamate Formula: C35H70N2O6 MolecularWeight: 614.9401

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H35NO4.C17H35NO2/c1-3-5-7-8-9-10-11-13-15-23-17(20)16(19-18(21)22)14-12-6-4-2;1-3-5-7-8-9-10-11-13-15-20-17(19)16(18)14-12-6-4-2/h16,19H,3-15H2,1-2H3,(H,21,22);16H,3-15,18H2,1-2H3