2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-[2-chloro-5-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-[2-chloro-5-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-(2-chloro-5-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-(2-chloro-5-piperidinosulfonyl-phenyl)acetamide Formula: C19H28ClN4O3S+ MolecularWeight: 427.96862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)C[N+]34CCN(CC3)CC4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)C[N+]34CCN(CC3)CC4

InChI

InChI=1S/C19H27ClN4O3S/c20-17-5-4-16(28(26,27)23-6-2-1-3-7-23)14-18(17)21-19(25)15-24-11-8-22(9-12-24)10-13-24/h4-5,14H,1-3,6-13,15H2/p+1