[(1S)-2-azaniumyl-1-thiophen-3-yl-ethyl]-methyl-(phenylmethyl)azanium

Systemtic Name: [(1S)-2-azaniumyl-1-thiophen-3-yl-ethyl]-methyl-(phenylmethyl)azanium Openeye Name: [(1S)-2-azaniumyl-1-(3-thienyl)ethyl]-benzyl-methyl-ammonium CAS Name: [(1S)-2-ammonio-1-(3-thiophenyl)ethyl]-methyl-(phenylmethyl)ammonium IUPAC Name: [(1S)-2-azaniumyl-1-thiophen-3-ylethyl]-benzyl-methylazanium Traditional Name: [(1S)-2-ammonio-1-(3-thienyl)ethyl]-benzyl-methyl-ammonium Formula: C14H20N2S+2 MolecularWeight: 248.387

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)C(C[NH3+])C2=CSC=C2

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)[C@H](C[NH3+])C2=CSC=C2

InChI

InChI=1S/C14H18N2S/c1-16(10-12-5-3-2-4-6-12)14(9-15)13-7-8-17-11-13/h2-8,11,14H,9-10,15H2,1H3/p+2/t14-/m1/s1