(E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(4-methyl-3-nitro-phenyl)prop-2-enamide

Systemtic Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(4-methyl-3-nitro-phenyl)prop-2-enamide Openeye Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(4-methyl-3-nitro-phenyl)prop-2-enamide CAS Name: (E)-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-N-(4-methyl-3-nitrophenyl)-2-propenamide IUPAC Name: (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide Traditional Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(4-methyl-3-nitro-phenyl)acrylamide Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C=CC2=C(N(N=C2C)C3=CC=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)/C=C/C2=C(N(N=C2C)C3=CC=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O3/c1-14-9-10-17(13-20(14)25(27)28)22-21(26)12-11-19-15(2)23-24(16(19)3)18-7-5-4-6-8-18/h4-13H,1-3H3,(H,22,26)/b12-11+