[4-(2-methylbutan-2-yl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)cyclohexyl]methylazanium

Systemtic Name: [4-(2-methylbutan-2-yl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)cyclohexyl]methylazanium Openeye Name: [4-(1,1-dimethylpropyl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)cyclohexyl]methylammonium CAS Name: [4-(2-methylbutan-2-yl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)cyclohexyl]methylammonium IUPAC Name: [4-(2-methylbutan-2-yl)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)cyclohexyl]methylazanium Traditional Name: [4-tert-amyl-1-(4-methyl-1,4-diazepan-4-ium-1-yl)cyclohexyl]methylammonium Formula: C18H39N3+2 MolecularWeight: 297.52236

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC(CC1)(C[NH3+])N2CCC[NH+](CC2)C

Isomeric SMILES

CCC(C)(C)C1CCC(CC1)(C[NH3+])N2CCC[NH+](CC2)C

InChI

InChI=1S/C18H37N3/c1-5-17(2,3)16-7-9-18(15-19,10-8-16)21-12-6-11-20(4)13-14-21/h16H,5-15,19H2,1-4H3/p+2