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

Systemtic Name: (E)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(2-methyl-5-nitro-phenyl)prop-2-enamide Openeye Name: (E)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(2-methyl-5-nitro-phenyl)prop-2-enamide CAS Name: (E)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]-N-(2-methyl-5-nitrophenyl)-2-propenamide IUPAC Name: (E)-3-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]-N-(2-methyl-5-nitrophenyl)prop-2-enamide Traditional Name: (E)-3-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(2-methyl-5-nitro-phenyl)acrylamide Formula: C27H24N4O5 MolecularWeight: 484.50326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C=CC2=CN(N=C2C3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)/C=C/C2=CN(N=C2C3=CC(=C(C=C3)OC)OC)C4=CC=CC=C4

InChI

InChI=1S/C27H24N4O5/c1-18-9-12-22(31(33)34)16-23(18)28-26(32)14-11-20-17-30(21-7-5-4-6-8-21)29-27(20)19-10-13-24(35-2)25(15-19)36-3/h4-17H,1-3H3,(H,28,32)/b14-11+