[(2R)-6-methyl-6-oxidanyl-heptan-2-yl]-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium

Systemtic Name: [(2R)-6-methyl-6-oxidanyl-heptan-2-yl]-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-[(1R)-5-hydroxy-1,5-dimethyl-hexyl]ammonium CAS Name: [(2R)-6-hydroxy-6-methylheptan-2-yl]-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-[(2R)-6-hydroxy-6-methylheptan-2-yl]azanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-[(1R)-5-hydroxy-1,5-dimethyl-hexyl]ammonium Formula: C20H36N2O+2 MolecularWeight: 320.51264

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)(C)O)[NH2+]C1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

C[C@H](CCCC(C)(C)O)[NH2+]C1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C20H34N2O/c1-17(8-7-13-20(2,3)23)21-19-11-14-22(15-12-19)16-18-9-5-4-6-10-18/h4-6,9-10,17,19,21,23H,7-8,11-16H2,1-3H3/p+2/t17-/m1/s1