2-[(E)-2-(dioxidanyl)prop-1-enyl]-3-nitro-pyridine

Systemtic Name: 2-[(E)-2-(dioxidanyl)prop-1-enyl]-3-nitro-pyridine Openeye Name: 2-[(E)-2-hydroperoxyprop-1-enyl]-3-nitro-pyridine CAS Name: 2-[(E)-2-hydroperoxyprop-1-enyl]-3-nitropyridine IUPAC Name: 2-[(E)-2-hydroperoxyprop-1-enyl]-3-nitropyridine Traditional Name: 2-[(E)-2-hydroperoxyprop-1-enyl]-3-nitro-pyridine Formula: C8H8N2O4 MolecularWeight: 196.16012

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=C(C=CC=N1)[N+](=O)[O-])OO

Isomeric SMILES

C/C(=C\C1=C(C=CC=N1)[N+](=O)[O-])/OO

InChI

InChI=1S/C8H8N2O4/c1-6(14-13)5-7-8(10(11)12)3-2-4-9-7/h2-5,13H,1H3/b6-5+