[(3S,5S)-5-methylheptan-3-yl]-[(2R)-3-methyl-2-pyrrolidin-1-ium-1-yl-butyl]azanium

Systemtic Name: [(3S,5S)-5-methylheptan-3-yl]-[(2R)-3-methyl-2-pyrrolidin-1-ium-1-yl-butyl]azanium Openeye Name: [(1S,3S)-1-ethyl-3-methyl-pentyl]-[(2R)-3-methyl-2-pyrrolidin-1-ium-1-yl-butyl]ammonium CAS Name: [(3S,5S)-5-methylheptan-3-yl]-[(2R)-3-methyl-2-(1-pyrrolidin-1-iumyl)butyl]ammonium IUPAC Name: [(3S,5S)-5-methylheptan-3-yl]-[(2R)-3-methyl-2-pyrrolidin-1-ium-1-ylbutyl]azanium Traditional Name: [(1S,3S)-1-ethyl-3-methyl-pentyl]-[(2R)-3-methyl-2-pyrrolidin-1-ium-1-yl-butyl]ammonium Formula: C17H38N2+2 MolecularWeight: 270.49702

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(CC)[NH2+]CC(C(C)C)[NH+]1CCCC1

Isomeric SMILES

CC[C@H](C)C[C@H](CC)[NH2+]C[C@@H](C(C)C)[NH+]1CCCC1

InChI

InChI=1S/C17H36N2/c1-6-15(5)12-16(7-2)18-13-17(14(3)4)19-10-8-9-11-19/h14-18H,6-13H2,1-5H3/p+2/t15-,16-,17-/m0/s1