(4-chlorophenyl)-(2-methyl-4,6-dinitro-5-oxidanyl-1-benzofuran-3-yl)methanone

Systemtic Name: (4-chlorophenyl)-(2-methyl-4,6-dinitro-5-oxidanyl-1-benzofuran-3-yl)methanone Openeye Name: (4-chlorophenyl)-(5-hydroxy-2-methyl-4,6-dinitro-benzofuran-3-yl)methanone CAS Name: (4-chlorophenyl)-(5-hydroxy-2-methyl-4,6-dinitro-3-benzofuranyl)methanone IUPAC Name: (4-chlorophenyl)-(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone Traditional Name: (4-chlorophenyl)-(5-hydroxy-2-methyl-4,6-dinitro-benzofuran-3-yl)methanone Formula: C16H9ClN2O7 MolecularWeight: 376.70486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=C(C(=C2[N+](=O)[O-])O)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C2=C(O1)C=C(C(=C2[N+](=O)[O-])O)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H9ClN2O7/c1-7-12(15(20)8-2-4-9(17)5-3-8)13-11(26-7)6-10(18(22)23)16(21)14(13)19(24)25/h2-6,21H,1H3