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

Systemtic Name: (1-oxidanylidene-1-pentoxy-heptan-2-yl)azanium; N-(1-oxidanylidene-1-pentoxy-heptan-2-yl)carbamate Openeye Name: 1-pentoxycarbonylhexylammonium; N-(1-pentoxycarbonylhexyl)carbamate CAS Name: (1-oxo-1-pentoxyheptan-2-yl)ammonium; N-(1-oxo-1-pentoxyheptan-2-yl)carbamate IUPAC Name: (1-oxo-1-pentoxyheptan-2-yl)azanium; N-(1-oxo-1-pentoxyheptan-2-yl)carbamate Traditional Name: 1-amoxycarbonylhexylammonium; N-(1-amoxycarbonylhexyl)carbamate Formula: C25H50N2O6 MolecularWeight: 474.6743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=O)OCCCCC)[NH3+].CCCCCC(C(=O)OCCCCC)NC(=O)[O-]

Isomeric SMILES

CCCCCC(C(=O)OCCCCC)[NH3+].CCCCCC(C(=O)OCCCCC)NC(=O)[O-]

InChI

InChI=1S/C13H25NO4.C12H25NO2/c1-3-5-7-9-11(14-13(16)17)12(15)18-10-8-6-4-2;1-3-5-7-9-11(13)12(14)15-10-8-6-4-2/h11,14H,3-10H2,1-2H3,(H,16,17);11H,3-10,13H2,1-2H3