2-nitro-N-[2-oxidanylidene-2-(3-oxidanylpyrrolidin-1-yl)-1-phenyl-ethyl]-N-prop-2-enyl-benzenesulfonamide

Systemtic Name: 2-nitro-N-[2-oxidanylidene-2-(3-oxidanylpyrrolidin-1-yl)-1-phenyl-ethyl]-N-prop-2-enyl-benzenesulfonamide Openeye Name: N-allyl-N-[2-(3-hydroxypyrrolidin-1-yl)-2-oxo-1-phenyl-ethyl]-2-nitro-benzenesulfonamide CAS Name: N-[2-(3-hydroxy-1-pyrrolidinyl)-2-oxo-1-phenylethyl]-2-nitro-N-prop-2-enylbenzenesulfonamide IUPAC Name: N-[2-(3-hydroxypyrrolidin-1-yl)-2-oxo-1-phenylethyl]-2-nitro-N-prop-2-enylbenzenesulfonamide Traditional Name: N-allyl-N-[2-(3-hydroxypyrrolidino)-2-keto-1-phenyl-ethyl]-2-nitro-benzenesulfonamide Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C(C1=CC=CC=C1)C(=O)N2CCC(C2)O)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C=CCN(C(C1=CC=CC=C1)C(=O)N2CCC(C2)O)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O6S/c1-2-13-23(31(29,30)19-11-7-6-10-18(19)24(27)28)20(16-8-4-3-5-9-16)21(26)22-14-12-17(25)15-22/h2-11,17,20,25H,1,12-15H2