1-(2-adamantyl)-4-methyl-1,4-diazepan-1-ium-5-one

Systemtic Name: 1-(2-adamantyl)-4-methyl-1,4-diazepan-1-ium-5-one Openeye Name: 1-(2-adamantyl)-4-methyl-1,4-diazepan-1-ium-5-one CAS Name: 1-(2-adamantyl)-4-methyl-1,4-diazepan-1-ium-5-one IUPAC Name: 1-(2-adamantyl)-4-methyl-1,4-diazepan-1-ium-5-one Traditional Name: 1-(2-adamantyl)-4-methyl-1,4-diazepan-1-ium-5-one Formula: C16H27N2O+ MolecularWeight: 263.39838

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[NH+](CCC1=O)C2C3CC4CC(C3)CC2C4

Isomeric SMILES

CN1CC[NH+](CCC1=O)C2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C16H26N2O/c1-17-4-5-18(3-2-15(17)19)16-13-7-11-6-12(9-13)10-14(16)8-11/h11-14,16H,2-10H2,1H3/p+1