1-adamantyloxycarbonyl(hexyl)azanium; N-(1-adamantyloxycarbonyl)-N-hexyl-carbamate

Systemtic Name: 1-adamantyloxycarbonyl(hexyl)azanium; N-(1-adamantyloxycarbonyl)-N-hexyl-carbamate Openeye Name: 1-adamantyloxycarbonyl(hexyl)ammonium; N-(1-adamantyloxycarbonyl)-N-hexyl-carbamate CAS Name: [1-adamantyloxy(oxo)methyl]-hexylammonium; N-[1-adamantyloxy(oxo)methyl]-N-hexylcarbamate IUPAC Name: 1-adamantyloxycarbonyl(hexyl)azanium; N-(1-adamantyloxycarbonyl)-N-hexylcarbamate Traditional Name: 1-adamantyloxycarbonyl(hexyl)ammonium; N-(1-adamantyloxycarbonyl)-N-hexyl-carbamate Formula: C35H58N2O6 MolecularWeight: 602.84482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH2+]C(=O)OC12CC3CC(C1)CC(C3)C2.CCCCCCN(C(=O)[O-])C(=O)OC12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CCCCCC[NH2+]C(=O)OC12CC3CC(C1)CC(C3)C2.CCCCCCN(C(=O)[O-])C(=O)OC12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C18H29NO4.C17H29NO2/c1-2-3-4-5-6-19(16(20)21)17(22)23-18-10-13-7-14(11-18)9-15(8-13)12-18;1-2-3-4-5-6-18-16(19)20-17-10-13-7-14(11-17)9-15(8-13)12-17/h13-15H,2-12H2,1H3,(H,20,21);13-15H,2-12H2,1H3,(H,18,19)