3-[(3R)-1-(4-nitrophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylpropanoate

Systemtic Name: 3-[(3R)-1-(4-nitrophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylpropanoate Openeye Name: 3-[(3R)-1-(4-nitrophenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanylpropanoate CAS Name: 3-[[(3R)-1-(4-nitrophenyl)-2,5-dioxo-3-pyrrolidinyl]thio]propanoate IUPAC Name: 3-[(3R)-1-(4-nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpropanoate Traditional Name: 3-[[(3R)-2,5-diketo-1-(4-nitrophenyl)pyrrolidin-3-yl]thio]propionate Formula: C13H11N2O6S- MolecularWeight: 323.30124

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])SCCC(=O)[O-]

Isomeric SMILES

C1[C@H](C(=O)N(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])SCCC(=O)[O-]

InChI

InChI=1S/C13H12N2O6S/c16-11-7-10(22-6-5-12(17)18)13(19)14(11)8-1-3-9(4-2-8)15(20)21/h1-4,10H,5-7H2,(H,17,18)/p-1/t10-/m1/s1