4-chloranyl-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-chloro-N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-3-pyrrolidinosulfonyl-benzamide Formula: C22H33ClN3O4S+ MolecularWeight: 471.03312

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3)[NH+]4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3)[NH+]4CCOCC4

InChI

InChI=1S/C22H32ClN3O4S/c23-19-7-6-18(16-20(19)31(28,29)26-10-4-5-11-26)21(27)24-17-22(8-2-1-3-9-22)25-12-14-30-15-13-25/h6-7,16H,1-5,8-15,17H2,(H,24,27)/p+1