(E)-3-(4,5-dimethoxy-2-nitro-phenyl)-2-(phenylcarbonyl)prop-2-enenitrile

Systemtic Name: (E)-3-(4,5-dimethoxy-2-nitro-phenyl)-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-(4,5-dimethoxy-2-nitro-phenyl)prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-(4,5-dimethoxy-2-nitrophenyl)-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-(4,5-dimethoxy-2-nitrophenyl)prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-(4,5-dimethoxy-2-nitro-phenyl)acrylonitrile Formula: C18H14N2O5 MolecularWeight: 338.31416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C(C#N)C(=O)C2=CC=CC=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C(\C#N)/C(=O)C2=CC=CC=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C18H14N2O5/c1-24-16-9-13(15(20(22)23)10-17(16)25-2)8-14(11-19)18(21)12-6-4-3-5-7-12/h3-10H,1-2H3/b14-8+