2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(1-aza-4-azoniabicyclo[2.2.2]octan-4-yl)-N-(4-methyl-3-piperidinosulfonyl-phenyl)acetamide Formula: C20H31N4O3S+ MolecularWeight: 407.55014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C[N+]23CCN(CC2)CC3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[N+]23CCN(CC2)CC3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C20H30N4O3S/c1-17-5-6-18(15-19(17)28(26,27)23-7-3-2-4-8-23)21-20(25)16-24-12-9-22(10-13-24)11-14-24/h5-6,15H,2-4,7-14,16H2,1H3/p+1