(E)-2-cyano-3-[4-[methyl(phenyl)amino]-3-nitro-phenyl]-N-phenethyl-prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[4-[methyl(phenyl)amino]-3-nitro-phenyl]-N-phenethyl-prop-2-enamide Openeye Name: (E)-2-cyano-3-[4-(N-methylanilino)-3-nitro-phenyl]-N-phenethyl-prop-2-enamide CAS Name: (E)-2-cyano-3-[4-(N-methylanilino)-3-nitrophenyl]-N-phenethyl-2-propenamide IUPAC Name: (E)-2-cyano-3-[4-(N-methylanilino)-3-nitrophenyl]-N-phenethylprop-2-enamide Traditional Name: (E)-2-cyano-3-[4-(N-methylanilino)-3-nitro-phenyl]-N-phenethyl-acrylamide Formula: C25H22N4O3 MolecularWeight: 426.46718

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C2=C(C=C(C=C2)C=C(C#N)C(=O)NCCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C1=CC=CC=C1)C2=C(C=C(C=C2)/C=C(\C#N)/C(=O)NCCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H22N4O3/c1-28(22-10-6-3-7-11-22)23-13-12-20(17-24(23)29(31)32)16-21(18-26)25(30)27-15-14-19-8-4-2-5-9-19/h2-13,16-17H,14-15H2,1H3,(H,27,30)/b21-16+