[4-(2-methylbutan-2-yl)-1-[(3S)-3-methylpiperidin-1-ium-1-yl]cyclohexyl]methylazanium

Systemtic Name: [4-(2-methylbutan-2-yl)-1-[(3S)-3-methylpiperidin-1-ium-1-yl]cyclohexyl]methylazanium Openeye Name: [4-(1,1-dimethylpropyl)-1-[(3S)-3-methylpiperidin-1-ium-1-yl]cyclohexyl]methylammonium CAS Name: [4-(2-methylbutan-2-yl)-1-[(3S)-3-methyl-1-piperidin-1-iumyl]cyclohexyl]methylammonium IUPAC Name: [4-(2-methylbutan-2-yl)-1-[(3S)-3-methylpiperidin-1-ium-1-yl]cyclohexyl]methylazanium Traditional Name: [4-tert-amyl-1-[(3S)-3-methylpiperidin-1-ium-1-yl]cyclohexyl]methylammonium Formula: C18H38N2+2 MolecularWeight: 282.50772

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC(CC1)(C[NH3+])[NH+]2CCCC(C2)C

Isomeric SMILES

CCC(C)(C)C1CCC(CC1)(C[NH3+])[NH+]2CCC[C@@H](C2)C

InChI

InChI=1S/C18H36N2/c1-5-17(3,4)16-8-10-18(14-19,11-9-16)20-12-6-7-15(2)13-20/h15-16H,5-14,19H2,1-4H3/p+2/t15-,16?,18?/m0/s1