3-(2,4-dinitrophenyl)sulfanyl-6-methyl-2-oxidanyl-pyran-4-one

Systemtic Name: 3-(2,4-dinitrophenyl)sulfanyl-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 3-(2,4-dinitrophenyl)sulfanyl-2-hydroxy-6-methyl-pyran-4-one CAS Name: 3-[(2,4-dinitrophenyl)thio]-2-hydroxy-6-methyl-4-pyranone IUPAC Name: 3-(2,4-dinitrophenyl)sulfanyl-2-hydroxy-6-methylpyran-4-one Traditional Name: 3-[(2,4-dinitrophenyl)thio]-2-hydroxy-6-methyl-pyran-4-one Formula: C12H8N2O7S MolecularWeight: 324.26612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H8N2O7S/c1-6-4-9(15)11(12(16)21-6)22-10-3-2-7(13(17)18)5-8(10)14(19)20/h2-5,16H,1H3