(E)-3-(4,5-dimethoxy-2-nitro-phenyl)-1-(5-methyl-1-phenyl-pyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(4,5-dimethoxy-2-nitro-phenyl)-1-(5-methyl-1-phenyl-pyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-3-(4,5-dimethoxy-2-nitro-phenyl)-1-(5-methyl-1-phenyl-pyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-3-(4,5-dimethoxy-2-nitrophenyl)-1-(5-methyl-1-phenyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-3-(4,5-dimethoxy-2-nitrophenyl)-1-(5-methyl-1-phenylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-3-(4,5-dimethoxy-2-nitro-phenyl)-1-(5-methyl-1-phenyl-pyrazol-4-yl)prop-2-en-1-one Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)C=CC3=CC(=C(C=C3[N+](=O)[O-])OC)OC

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)/C=C/C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

InChI

InChI=1S/C21H19N3O5/c1-14-17(13-22-23(14)16-7-5-4-6-8-16)19(25)10-9-15-11-20(28-2)21(29-3)12-18(15)24(26)27/h4-13H,1-3H3/b10-9+