[(2S)-2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]-2-(3-methylthiophen-2-yl)ethyl]azanium

Systemtic Name: [(2S)-2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]-2-(3-methylthiophen-2-yl)ethyl]azanium Openeye Name: [(2S)-2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]-2-(3-methyl-2-thienyl)ethyl]ammonium CAS Name: [(2S)-2-[methyl-(1-methyl-4-piperidin-1-iumyl)amino]-2-(3-methyl-2-thiophenyl)ethyl]ammonium IUPAC Name: [(2S)-2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]-2-(3-methylthiophen-2-yl)ethyl]azanium Traditional Name: [(2S)-2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]-2-(3-methyl-2-thienyl)ethyl]ammonium Formula: C14H27N3S+2 MolecularWeight: 269.44928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(C[NH3+])N(C)C2CC[NH+](CC2)C

Isomeric SMILES

CC1=C(SC=C1)[C@H](C[NH3+])N(C)C2CC[NH+](CC2)C

InChI

InChI=1S/C14H25N3S/c1-11-6-9-18-14(11)13(10-15)17(3)12-4-7-16(2)8-5-12/h6,9,12-13H,4-5,7-8,10,15H2,1-3H3/p+2/t13-/m0/s1