N-[(1S)-1-(2,5-dimethylthiophen-3-yl)ethyl]-2,2,6,6-tetramethyl-piperidin-1-ium-4-amine

Systemtic Name: N-[(1S)-1-(2,5-dimethylthiophen-3-yl)ethyl]-2,2,6,6-tetramethyl-piperidin-1-ium-4-amine Openeye Name: N-[(1S)-1-(2,5-dimethyl-3-thienyl)ethyl]-2,2,6,6-tetramethyl-piperidin-1-ium-4-amine CAS Name: N-[(1S)-1-(2,5-dimethyl-3-thiophenyl)ethyl]-2,2,6,6-tetramethyl-4-piperidin-1-iumamine IUPAC Name: N-[(1S)-1-(2,5-dimethylthiophen-3-yl)ethyl]-2,2,6,6-tetramethylpiperidin-1-ium-4-amine Traditional Name: [(1S)-1-(2,5-dimethyl-3-thienyl)ethyl]-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)amine Formula: C17H31N2S+ MolecularWeight: 295.50644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(C)NC2CC([NH2+]C(C2)(C)C)(C)C

Isomeric SMILES

CC1=CC(=C(S1)C)[C@H](C)NC2CC([NH2+]C(C2)(C)C)(C)C

InChI

InChI=1S/C17H30N2S/c1-11-8-15(13(3)20-11)12(2)18-14-9-16(4,5)19-17(6,7)10-14/h8,12,14,18-19H,9-10H2,1-7H3/p+1/t12-/m0/s1