1-(4-nitrophenyl)sulfonyl-1-propoxy-pyrrolidin-1-ium-2-one

Systemtic Name: 1-(4-nitrophenyl)sulfonyl-1-propoxy-pyrrolidin-1-ium-2-one Openeye Name: 1-(4-nitrophenyl)sulfonyl-1-propoxy-pyrrolidin-1-ium-2-one CAS Name: 1-(4-nitrophenyl)sulfonyl-1-propoxy-2-pyrrolidin-1-iumone IUPAC Name: 1-(4-nitrophenyl)sulfonyl-1-propoxypyrrolidin-1-ium-2-one Traditional Name: 1-nosyl-1-propoxy-pyrrolidin-1-ium-2-one Formula: C13H17N2O6S+ MolecularWeight: 329.34888

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Descriptors Computed from Structure

Canonical SMILES:

CCCO[N+]1(CCCC1=O)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCO[N+]1(CCCC1=O)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H17N2O6S/c1-2-10-21-15(9-3-4-13(15)16)22(19,20)12-7-5-11(6-8-12)14(17)18/h5-8H,2-4,9-10H2,1H3/q+1