(5S)-1-butyl-4-[(4-methylphenyl)-oxidanyl-methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione

Systemtic Name: (5S)-1-butyl-4-[(4-methylphenyl)-oxidanyl-methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione Openeye Name: (5S)-1-butyl-4-[hydroxy(p-tolyl)methylene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione CAS Name: (5S)-1-butyl-4-[hydroxy-(4-methylphenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione IUPAC Name: (5S)-1-butyl-4-[hydroxy-(4-methylphenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione Traditional Name: (5S)-1-butyl-4-[hydroxy(p-tolyl)methylene]-5-(4-nitrophenyl)pyrrolidine-2,3-quinone Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(=C(C2=CC=C(C=C2)C)O)C(=O)C1=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCN1[C@H](C(=C(C2=CC=C(C=C2)C)O)C(=O)C1=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H22N2O5/c1-3-4-13-23-19(15-9-11-17(12-10-15)24(28)29)18(21(26)22(23)27)20(25)16-7-5-14(2)6-8-16/h5-12,19,25H,3-4,13H2,1-2H3/t19-/m0/s1