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

Systemtic Name: (2-methyl-4,6-dinitro-5-oxidanyl-1-benzofuran-3-yl)-phenyl-methanone Openeye Name: (5-hydroxy-2-methyl-4,6-dinitro-benzofuran-3-yl)-phenyl-methanone CAS Name: (5-hydroxy-2-methyl-4,6-dinitro-3-benzofuranyl)-phenylmethanone IUPAC Name: (5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)-phenylmethanone Traditional Name: (5-hydroxy-2-methyl-4,6-dinitro-benzofuran-3-yl)-phenyl-methanone Formula: C16H10N2O7 MolecularWeight: 342.2598

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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=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C16H10N2O7/c1-8-12(15(19)9-5-3-2-4-6-9)13-11(25-8)7-10(17(21)22)16(20)14(13)18(23)24/h2-7,20H,1H3