3-(2-tert-butyl-4-oxidanyl-phenyl)-6-nitro-3-oxidanyl-1H-quinoline-2,4-dione

Systemtic Name: 3-(2-tert-butyl-4-oxidanyl-phenyl)-6-nitro-3-oxidanyl-1H-quinoline-2,4-dione Openeye Name: 3-(2-tert-butyl-4-hydroxy-phenyl)-3-hydroxy-6-nitro-1H-quinoline-2,4-dione CAS Name: 3-(2-tert-butyl-4-hydroxyphenyl)-3-hydroxy-6-nitro-1H-quinoline-2,4-dione IUPAC Name: 3-(2-tert-butyl-4-hydroxyphenyl)-3-hydroxy-6-nitro-1H-quinoline-2,4-dione Traditional Name: 3-(2-tert-butyl-4-hydroxy-phenyl)-3-hydroxy-6-nitro-1H-quinoline-2,4-quinone Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)O)C2(C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)O)C2(C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)O

InChI

InChI=1S/C19H18N2O6/c1-18(2,3)14-9-11(22)5-6-13(14)19(25)16(23)12-8-10(21(26)27)4-7-15(12)20-17(19)24/h4-9,22,25H,1-3H3,(H,20,24)