[(2S)-heptan-2-yl]-(2-pyrrolidin-1-ylethyl)azanium

Systemtic Name: [(2S)-heptan-2-yl]-(2-pyrrolidin-1-ylethyl)azanium Openeye Name: [(1S)-1-methylhexyl]-(2-pyrrolidin-1-ylethyl)ammonium CAS Name: [(2S)-heptan-2-yl]-[2-(1-pyrrolidinyl)ethyl]ammonium IUPAC Name: [(2S)-heptan-2-yl]-(2-pyrrolidin-1-ylethyl)azanium Traditional Name: [(1S)-1-methylhexyl]-(2-pyrrolidinoethyl)ammonium Formula: C13H29N2+ MolecularWeight: 213.38276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)[NH2+]CCN1CCCC1

Isomeric SMILES

CCCCC[C@H](C)[NH2+]CCN1CCCC1

InChI

InChI=1S/C13H28N2/c1-3-4-5-8-13(2)14-9-12-15-10-6-7-11-15/h13-14H,3-12H2,1-2H3/p+1/t13-/m0/s1