1-nitro-2-[(E)-2-nitrobut-1-enyl]benzene

Systemtic Name: 1-nitro-2-[(E)-2-nitrobut-1-enyl]benzene Openeye Name: 1-nitro-2-[(E)-2-nitrobut-1-enyl]benzene CAS Name: 1-nitro-2-[(E)-2-nitrobut-1-enyl]benzene IUPAC Name: 1-nitro-2-[(E)-2-nitrobut-1-enyl]benzene Traditional Name: 1-nitro-2-[(E)-2-nitrobut-1-enyl]benzene Formula: C10H10N2O4 MolecularWeight: 222.1974

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC1=CC=CC=C1[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C10H10N2O4/c1-2-9(11(13)14)7-8-5-3-4-6-10(8)12(15)16/h3-7H,2H2,1H3/b9-7+