(E)-2-cyano-3-[3-(4-ethoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]-N-(1-phenylethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[3-(4-ethoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]-N-(1-phenylethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[3-(4-ethoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]-N-(1-phenylethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[3-(4-ethoxy-3-nitrophenyl)-1-phenyl-4-pyrazolyl]-N-(1-phenylethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-N-(1-phenylethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[3-(4-ethoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]-N-(1-phenylethyl)acrylamide Formula: C29H25N5O4 MolecularWeight: 507.5399

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC(C)C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NC(C)C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C29H25N5O4/c1-3-38-27-15-14-22(17-26(27)34(36)37)28-24(19-33(32-28)25-12-8-5-9-13-25)16-23(18-30)29(35)31-20(2)21-10-6-4-7-11-21/h4-17,19-20H,3H2,1-2H3,(H,31,35)/b23-16+