[4-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]piperidin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]piperidin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-1-piperidyl]-(2-thienyl)methanone CAS Name: [4-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]-1-piperidinyl]-thiophen-2-ylmethanone IUPAC Name: [4-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]piperidin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]piperidino]-(2-thienyl)methanone Formula: C17H27N2OS+ MolecularWeight: 307.47408

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)C2CCN(CC2)C(=O)C3=CC=CS3)C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)C2CCN(CC2)C(=O)C3=CC=CS3)C

InChI

InChI=1S/C17H26N2OS/c1-13-10-14(2)12-19(11-13)15-5-7-18(8-6-15)17(20)16-4-3-9-21-16/h3-4,9,13-15H,5-8,10-12H2,1-2H3/p+1/t13-,14-/m1/s1