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

Systemtic Name: 1-adamantyloxycarbonyl(heptyl)azanium; N-(1-adamantyloxycarbonyl)-N-heptyl-carbamate Openeye Name: 1-adamantyloxycarbonyl(heptyl)ammonium; N-(1-adamantyloxycarbonyl)-N-heptyl-carbamate CAS Name: [1-adamantyloxy(oxo)methyl]-heptylammonium; N-[1-adamantyloxy(oxo)methyl]-N-heptylcarbamate IUPAC Name: 1-adamantyloxycarbonyl(heptyl)azanium; N-(1-adamantyloxycarbonyl)-N-heptylcarbamate Traditional Name: 1-adamantyloxycarbonyl(heptyl)ammonium; N-(1-adamantyloxycarbonyl)-N-heptyl-carbamate Formula: C37H62N2O6 MolecularWeight: 630.89798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H31NO4.C18H31NO2/c1-2-3-4-5-6-7-20(17(21)22)18(23)24-19-11-14-8-15(12-19)10-16(9-14)13-19;1-2-3-4-5-6-7-19-17(20)21-18-11-14-8-15(12-18)10-16(9-14)13-18/h14-16H,2-13H2,1H3,(H,21,22);14-16H,2-13H2,1H3,(H,19,20)