[(3S)-3-[2-(azaniumylmethyl)thiophen-3-yl]oxybutyl]-diethyl-azanium

Systemtic Name: [(3S)-3-[2-(azaniumylmethyl)thiophen-3-yl]oxybutyl]-diethyl-azanium Openeye Name: [(3S)-3-[[2-(azaniumylmethyl)-3-thienyl]oxy]butyl]-diethyl-ammonium CAS Name: [(3S)-3-[[2-(ammoniomethyl)-3-thiophenyl]oxy]butyl]-diethylammonium IUPAC Name: [(3S)-3-[2-(azaniumylmethyl)thiophen-3-yl]oxybutyl]-diethylazanium Traditional Name: [(3S)-3-[[2-(ammoniomethyl)-3-thienyl]oxy]butyl]-diethyl-ammonium Formula: C13H26N2OS+2 MolecularWeight: 258.42334

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC(C)OC1=C(SC=C1)C[NH3+]

Isomeric SMILES

CC[NH+](CC)CC[C@H](C)OC1=C(SC=C1)C[NH3+]

InChI

InChI=1S/C13H24N2OS/c1-4-15(5-2)8-6-11(3)16-12-7-9-17-13(12)10-14/h7,9,11H,4-6,8,10,14H2,1-3H3/p+2/t11-/m0/s1