N-[6-(7-methyloctoxy)-6-oxidanylidene-hexyl]carbamate; [5-(7-methyloctoxy)-5-oxidanylidene-pentyl]azanium

Systemtic Name: N-[6-(7-methyloctoxy)-6-oxidanylidene-hexyl]carbamate; [5-(7-methyloctoxy)-5-oxidanylidene-pentyl]azanium Openeye Name: N-[6-(7-methyloctoxy)-6-oxo-hexyl]carbamate; [5-(7-methyloctoxy)-5-oxo-pentyl]ammonium CAS Name: N-[6-(7-methyloctoxy)-6-oxohexyl]carbamate; [5-(7-methyloctoxy)-5-oxopentyl]ammonium IUPAC Name: N-[6-(7-methyloctoxy)-6-oxohexyl]carbamate; [5-(7-methyloctoxy)-5-oxopentyl]azanium Traditional Name: N-[6-keto-6-(7-methyloctoxy)hexyl]carbamate; [5-keto-5-(7-methyloctoxy)pentyl]ammonium Formula: C30H60N2O6 MolecularWeight: 544.8072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCOC(=O)CCCCCNC(=O)[O-].CC(C)CCCCCCOC(=O)CCCC[NH3+]

Isomeric SMILES

CC(C)CCCCCCOC(=O)CCCCCNC(=O)[O-].CC(C)CCCCCCOC(=O)CCCC[NH3+]

InChI

InChI=1S/C16H31NO4.C14H29NO2/c1-14(2)10-6-3-4-9-13-21-15(18)11-7-5-8-12-17-16(19)20;1-13(2)9-5-3-4-8-12-17-14(16)10-6-7-11-15/h14,17H,3-13H2,1-2H3,(H,19,20);13H,3-12,15H2,1-2H3