3-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-[(5-methylthiophen-2-yl)methyl]propan-1-amine

Systemtic Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-[(5-methylthiophen-2-yl)methyl]propan-1-amine Openeye Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-[(5-methyl-2-thienyl)methyl]propan-1-amine CAS Name: 3-[(2S)-2-methyl-1-piperidin-1-iumyl]-N-[(5-methyl-2-thiophenyl)methyl]-1-propanamine IUPAC Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-[(5-methylthiophen-2-yl)methyl]propan-1-amine Traditional Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(5-methyl-2-thienyl)methyl]amine Formula: C15H27N2S+ MolecularWeight: 267.45328

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNCC2=CC=C(S2)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNCC2=CC=C(S2)C

InChI

InChI=1S/C15H26N2S/c1-13-6-3-4-10-17(13)11-5-9-16-12-15-8-7-14(2)18-15/h7-8,13,16H,3-6,9-12H2,1-2H3/p+1/t13-/m0/s1