4-chloranyl-N-(2-pyrrolidin-1-ium-1-ylethyl)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-(2-pyrrolidin-1-ium-1-ylethyl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-(2-pyrrolidin-1-ium-1-ylethyl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-chloro-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-(2-pyrrolidin-1-ium-1-ylethyl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-(2-pyrrolidin-1-ium-1-ylethyl)-3-pyrrolidinosulfonyl-benzamide Formula: C17H25ClN3O3S+ MolecularWeight: 386.9167

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

C1CC[NH+](C1)CCNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C17H24ClN3O3S/c18-15-6-5-14(17(22)19-7-12-20-8-1-2-9-20)13-16(15)25(23,24)21-10-3-4-11-21/h5-6,13H,1-4,7-12H2,(H,19,22)/p+1