[5-ethyl-2-(4-nitrophenyl)pyrazol-3-yl] (E)-3-phenylprop-2-enoate

Systemtic Name: [5-ethyl-2-(4-nitrophenyl)pyrazol-3-yl] (E)-3-phenylprop-2-enoate Openeye Name: [5-ethyl-2-(4-nitrophenyl)pyrazol-3-yl] (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid [5-ethyl-2-(4-nitrophenyl)-3-pyrazolyl] ester IUPAC Name: [5-ethyl-2-(4-nitrophenyl)pyrazol-3-yl] (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid [5-ethyl-2-(4-nitrophenyl)pyrazol-3-yl] ester Formula: C20H17N3O4 MolecularWeight: 363.36668

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1)OC(=O)C=CC2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=NN(C(=C1)OC(=O)/C=C/C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O4/c1-2-16-14-19(27-20(24)13-8-15-6-4-3-5-7-15)22(21-16)17-9-11-18(12-10-17)23(25)26/h3-14H,2H2,1H3/b13-8+