(E)-3-(3-nitro-2-oxidanyl-phenyl)prop-2-enenitrile

Systemtic Name: (E)-3-(3-nitro-2-oxidanyl-phenyl)prop-2-enenitrile Openeye Name: (E)-3-(2-hydroxy-3-nitro-phenyl)prop-2-enenitrile CAS Name: (E)-3-(2-hydroxy-3-nitrophenyl)-2-propenenitrile IUPAC Name: (E)-3-(2-hydroxy-3-nitrophenyl)prop-2-enenitrile Traditional Name: (E)-3-(2-hydroxy-3-nitro-phenyl)acrylonitrile Formula: C9H6N2O3 MolecularWeight: 190.15554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6N2O3/c10-6-2-4-7-3-1-5-8(9(7)12)11(13)14/h1-5,12H/b4-2+