(Z)-2-cyano-3-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-N-prop-2-enyl-prop-2-enamide

Systemtic Name: (Z)-2-cyano-3-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-N-prop-2-enyl-prop-2-enamide Openeye Name: (Z)-N-allyl-2-cyano-3-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide CAS Name: (Z)-2-cyano-3-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]-N-prop-2-enyl-2-propenamide IUPAC Name: (Z)-2-cyano-3-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]-N-prop-2-enylprop-2-enamide Traditional Name: (Z)-N-allyl-2-cyano-3-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acrylamide Formula: C22H17N5O3 MolecularWeight: 399.40208

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C(=CC1=CN(N=C1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C#N

Isomeric SMILES

C=CCNC(=O)/C(=C\C1=CN(N=C1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)/C#N

InChI

InChI=1S/C22H17N5O3/c1-2-12-24-22(28)17(14-23)13-18-15-26(19-6-4-3-5-7-19)25-21(18)16-8-10-20(11-9-16)27(29)30/h2-11,13,15H,1,12H2,(H,24,28)/b17-13-