(E)-3-(3-ethoxy-5-nitro-4-oxidanyl-phenyl)-2-(4-methylphenyl)prop-2-enenitrile

Systemtic Name: (E)-3-(3-ethoxy-5-nitro-4-oxidanyl-phenyl)-2-(4-methylphenyl)prop-2-enenitrile Openeye Name: (E)-3-(3-ethoxy-4-hydroxy-5-nitro-phenyl)-2-(p-tolyl)prop-2-enenitrile CAS Name: (E)-3-(3-ethoxy-4-hydroxy-5-nitrophenyl)-2-(4-methylphenyl)-2-propenenitrile IUPAC Name: (E)-3-(3-ethoxy-4-hydroxy-5-nitrophenyl)-2-(4-methylphenyl)prop-2-enenitrile Traditional Name: (E)-3-(3-ethoxy-4-hydroxy-5-nitro-phenyl)-2-(p-tolyl)acrylonitrile Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C=C(C#N)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])/C=C(/C#N)\C2=CC=C(C=C2)C

InChI

InChI=1S/C18H16N2O4/c1-3-24-17-10-13(9-16(18(17)21)20(22)23)8-15(11-19)14-6-4-12(2)5-7-14/h4-10,21H,3H2,1-2H3/b15-8-