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

Systemtic Name: 3-(3-methyl-4-oxidanyl-phenyl)-6-nitro-3-oxidanyl-1H-quinoline-2,4-dione Openeye Name: 3-hydroxy-3-(4-hydroxy-3-methyl-phenyl)-6-nitro-1H-quinoline-2,4-dione CAS Name: 3-hydroxy-3-(4-hydroxy-3-methylphenyl)-6-nitro-1H-quinoline-2,4-dione IUPAC Name: 3-hydroxy-3-(4-hydroxy-3-methylphenyl)-6-nitro-1H-quinoline-2,4-dione Traditional Name: 3-hydroxy-3-(4-hydroxy-3-methyl-phenyl)-6-nitro-1H-quinoline-2,4-quinone Formula: C16H12N2O6 MolecularWeight: 328.27628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2(C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C2(C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)O)O

InChI

InChI=1S/C16H12N2O6/c1-8-6-9(2-5-13(8)19)16(22)14(20)11-7-10(18(23)24)3-4-12(11)17-15(16)21/h2-7,19,22H,1H3,(H,17,21)