2-chloranyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]-5-pyrrolidinosulfonyl-benzamide Formula: C23H29ClN3O4S+ MolecularWeight: 479.01206

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3=CC=CC=C3C[NH+]4CCOCC4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3=CC=CC=C3C[NH+]4CCOCC4

InChI

InChI=1S/C23H28ClN3O4S/c24-22-8-7-20(32(29,30)27-9-3-4-10-27)15-21(22)23(28)25-16-18-5-1-2-6-19(18)17-26-11-13-31-14-12-26/h1-2,5-8,15H,3-4,9-14,16-17H2,(H,25,28)/p+1