(E)-1-(5-methyl-3-nitro-2-oxidanyl-phenyl)-3-(4-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(5-methyl-3-nitro-2-oxidanyl-phenyl)-3-(4-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-1-(2-hydroxy-5-methyl-3-nitro-phenyl)-3-(4-nitrophenyl)prop-2-en-1-one CAS Name: (E)-1-(2-hydroxy-5-methyl-3-nitrophenyl)-3-(4-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-(2-hydroxy-5-methyl-3-nitrophenyl)-3-(4-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(2-hydroxy-5-methyl-3-nitro-phenyl)-3-(4-nitrophenyl)prop-2-en-1-one Formula: C16H12N2O6 MolecularWeight: 328.27628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O6/c1-10-8-13(16(20)14(9-10)18(23)24)15(19)7-4-11-2-5-12(6-3-11)17(21)22/h2-9,20H,1H3/b7-4+