2-(1-adamantyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone

Systemtic Name: 2-(1-adamantyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone Openeye Name: 2-(1-adamantyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone CAS Name: 2-(1-adamantyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone IUPAC Name: 2-(1-adamantyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone Traditional Name: 2-(1-adamantyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)ethanone Formula: C18H31N2O+ MolecularWeight: 291.45154

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=O)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H30N2O/c1-19-3-2-4-20(6-5-19)17(21)13-18-10-14-7-15(11-18)9-16(8-14)12-18/h14-16H,2-13H2,1H3/p+1