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(3S)-3-hexyl-1-(phenylmethyl)pyrrolidin-1-ium

(3S)-3-hexyl-1-(phenylmethyl)pyrrolidin-1-ium

Systemtic Name:(3S)-3-hexyl-1-(phenylmethyl)pyrrolidin-1-ium
Openeye Name:(3S)-1-benzyl-3-hexyl-pyrrolidin-1-ium
CAS Name:(3S)-3-hexyl-1-(phenylmethyl)pyrrolidin-1-ium
IUPAC Name:(3S)-1-benzyl-3-hexylpyrrolidin-1-ium
Traditional Name:(3S)-1-benzyl-3-hexyl-pyrrolidin-1-ium
Formula: C17H28N+
MolecularWeight: 246.41092
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CC[NH+](C1)CC2=CC=CC=C2


Isomeric SMILES

CCCCCC[C@H]1CC[NH+](C1)CC2=CC=CC=C2


InChI

InChI=1S/C17H27N/c1-2-3-4-6-11-17-12-13-18(15-17)14-16-9-7-5-8-10-16/h5,7-10,17H,2-4,6,11-15H2,1H3/p+1/t17-/m0/s1


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