2-chloranyl-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[(2R)-2-(4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-5-pyrrolidinosulfonyl-benzamide Formula: C24H31ClN3O4S+ MolecularWeight: 493.03864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl)[NH+]4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl)[NH+]4CCCC4

InChI

InChI=1S/C24H30ClN3O4S/c1-32-19-8-6-18(7-9-19)23(27-12-2-3-13-27)17-26-24(29)21-16-20(10-11-22(21)25)33(30,31)28-14-4-5-15-28/h6-11,16,23H,2-5,12-15,17H2,1H3,(H,26,29)/p+1/t23-/m0/s1