3-(4-methylpiperidin-1-ium-1-yl)propyl-[(1S,2R,5R)-5-methyl-2-propan-2-yl-cyclohexyl]azanium

Systemtic Name: 3-(4-methylpiperidin-1-ium-1-yl)propyl-[(1S,2R,5R)-5-methyl-2-propan-2-yl-cyclohexyl]azanium Openeye Name: [(1S,2R,5R)-2-isopropyl-5-methyl-cyclohexyl]-[3-(4-methylpiperidin-1-ium-1-yl)propyl]ammonium CAS Name: 3-(4-methyl-1-piperidin-1-iumyl)propyl-[(1S,2R,5R)-5-methyl-2-propan-2-ylcyclohexyl]ammonium IUPAC Name: 3-(4-methylpiperidin-1-ium-1-yl)propyl-[(1S,2R,5R)-5-methyl-2-propan-2-ylcyclohexyl]azanium Traditional Name: [(1S,2R,5R)-2-isopropyl-5-methyl-cyclohexyl]-[3-(4-methylpiperidin-1-ium-1-yl)propyl]ammonium Formula: C19H40N2+2 MolecularWeight: 296.5343

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCC[NH2+]C2CC(CCC2C(C)C)C

Isomeric SMILES

C[C@@H]1CC[C@@H]([C@H](C1)[NH2+]CCC[NH+]2CCC(CC2)C)C(C)C

InChI

InChI=1S/C19H38N2/c1-15(2)18-7-6-17(4)14-19(18)20-10-5-11-21-12-8-16(3)9-13-21/h15-20H,5-14H2,1-4H3/p+2/t17-,18-,19+/m1/s1