[2-(2,2-dinitroethanoyl)phenyl] (E)-but-2-enoate

Systemtic Name: [2-(2,2-dinitroethanoyl)phenyl] (E)-but-2-enoate Openeye Name: [2-(2,2-dinitroacetyl)phenyl] (E)-but-2-enoate CAS Name: (E)-2-butenoic acid [2-(2,2-dinitro-1-oxoethyl)phenyl] ester IUPAC Name: [2-(2,2-dinitroacetyl)phenyl] (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid [2-(2,2-dinitroacetyl)phenyl] ester Formula: C12H10N2O7 MolecularWeight: 294.217

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)OC1=CC=CC=C1C(=O)C([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C/C=C/C(=O)OC1=CC=CC=C1C(=O)C([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H10N2O7/c1-2-5-10(15)21-9-7-4-3-6-8(9)11(16)12(13(17)18)14(19)20/h2-7,12H,1H3/b5-2+