3-(4-chloranyl-2-nitro-phenyl)carbonyl-6-(hydroxymethyl)oxane-2,4-dione

Systemtic Name: 3-(4-chloranyl-2-nitro-phenyl)carbonyl-6-(hydroxymethyl)oxane-2,4-dione Openeye Name: 3-(4-chloro-2-nitro-benzoyl)-6-(hydroxymethyl)tetrahydropyran-2,4-dione CAS Name: 3-[(4-chloro-2-nitrophenyl)-oxomethyl]-6-(hydroxymethyl)oxane-2,4-dione IUPAC Name: 3-(4-chloro-2-nitrobenzoyl)-6-(hydroxymethyl)oxane-2,4-dione Traditional Name: 3-(4-chloro-2-nitro-benzoyl)-6-methylol-tetrahydropyran-2,4-quinone Formula: C13H10ClNO7 MolecularWeight: 327.674

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C(C1=O)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])CO

Isomeric SMILES

C1C(OC(=O)C(C1=O)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])CO

InChI

InChI=1S/C13H10ClNO7/c14-6-1-2-8(9(3-6)15(20)21)12(18)11-10(17)4-7(5-16)22-13(11)19/h1-3,7,11,16H,4-5H2