1-[1-[(5-chloranylthiophen-2-yl)methyl]piperidin-1-ium-4-yl]-N-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[1-[(5-chloranylthiophen-2-yl)methyl]piperidin-1-ium-4-yl]-N-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[1-[(5-chloro-2-thienyl)methyl]piperidin-1-ium-4-yl]-N-(3-pyridylmethyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[1-[(5-chloro-2-thiophenyl)methyl]-4-piperidin-1-iumyl]-N-(3-pyridinylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[1-[(5-chlorothiophen-2-yl)methyl]piperidin-1-ium-4-yl]-N-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-[1-[(5-chloro-2-thienyl)methyl]piperidin-1-ium-4-yl]-N-(3-pyridylmethyl)piperidin-1-ium-4-carboxamide Formula: C22H31ClN4OS+2 MolecularWeight: 435.02574

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NCC2=CN=CC=C2)C3CC[NH+](CC3)CC4=CC=C(S4)Cl

Isomeric SMILES

C1C[NH+](CCC1C(=O)NCC2=CN=CC=C2)C3CC[NH+](CC3)CC4=CC=C(S4)Cl

InChI

InChI=1S/C22H29ClN4OS/c23-21-4-3-20(29-21)16-26-10-7-19(8-11-26)27-12-5-18(6-13-27)22(28)25-15-17-2-1-9-24-14-17/h1-4,9,14,18-19H,5-8,10-13,15-16H2,(H,25,28)/p+2