N-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[2-chloro-5-(1-piperidylsulfonyl)phenyl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[2-chloro-5-(1-piperidinylsulfonyl)phenyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-(2-chloro-5-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-(2-chloro-5-piperidinosulfonyl-phenyl)-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C17H25ClN3O3S+ MolecularWeight: 386.9167

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)C[NH+]3CCCC3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)C[NH+]3CCCC3

InChI

InChI=1S/C17H24ClN3O3S/c18-15-7-6-14(25(23,24)21-10-2-1-3-11-21)12-16(15)19-17(22)13-20-8-4-5-9-20/h6-7,12H,1-5,8-11,13H2,(H,19,22)/p+1