3-[3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]-N,N-dimethyl-prop-2-enamide

Systemtic Name: 3-[3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]-N,N-dimethyl-prop-2-enamide Openeye Name: 3-[3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]-N,N-dimethyl-prop-2-enamide CAS Name: 3-[3-(4-methoxy-3-nitrophenyl)-1-phenyl-4-pyrazolyl]-N,N-dimethyl-2-propenamide IUPAC Name: 3-[3-(4-methoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-N,N-dimethylprop-2-enamide Traditional Name: 3-[3-(4-methoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]-N,N-dimethyl-acrylamide Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4O4/c1-23(2)20(26)12-10-16-14-24(17-7-5-4-6-8-17)22-21(16)15-9-11-19(29-3)18(13-15)25(27)28/h4-14H,1-3H3