(E)-2-cyano-3-(3-nitro-4-piperidin-1-yl-phenyl)-N-phenethyl-prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(3-nitro-4-piperidin-1-yl-phenyl)-N-phenethyl-prop-2-enamide Openeye Name: (E)-2-cyano-3-[3-nitro-4-(1-piperidyl)phenyl]-N-phenethyl-prop-2-enamide CAS Name: (E)-2-cyano-3-[3-nitro-4-(1-piperidinyl)phenyl]-N-phenethyl-2-propenamide IUPAC Name: (E)-2-cyano-3-(3-nitro-4-piperidin-1-ylphenyl)-N-phenethylprop-2-enamide Traditional Name: (E)-2-cyano-3-(3-nitro-4-piperidino-phenyl)-N-phenethyl-acrylamide Formula: C23H24N4O3 MolecularWeight: 404.46166

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C=C(C#N)C(=O)NCCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)/C=C(\C#N)/C(=O)NCCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H24N4O3/c24-17-20(23(28)25-12-11-18-7-3-1-4-8-18)15-19-9-10-21(22(16-19)27(29)30)26-13-5-2-6-14-26/h1,3-4,7-10,15-16H,2,5-6,11-14H2,(H,25,28)/b20-15+