(3S)-1-(4-nitrophenyl)-3-propan-2-ylsulfanyl-pyrrolidine-2,5-dione

Systemtic Name: (3S)-1-(4-nitrophenyl)-3-propan-2-ylsulfanyl-pyrrolidine-2,5-dione Openeye Name: (3S)-3-isopropylsulfanyl-1-(4-nitrophenyl)pyrrolidine-2,5-dione CAS Name: (3S)-1-(4-nitrophenyl)-3-(propan-2-ylthio)pyrrolidine-2,5-dione IUPAC Name: (3S)-1-(4-nitrophenyl)-3-propan-2-ylsulfanylpyrrolidine-2,5-dione Traditional Name: (3S)-3-(isopropylthio)-1-(4-nitrophenyl)pyrrolidine-2,5-quinone Formula: C13H14N2O4S MolecularWeight: 294.32626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1CC(=O)N(C1=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)S[C@H]1CC(=O)N(C1=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O4S/c1-8(2)20-11-7-12(16)14(13(11)17)9-3-5-10(6-4-9)15(18)19/h3-6,8,11H,7H2,1-2H3/t11-/m0/s1