[5-ethyl-2-(4-nitrophenyl)pyrazol-3-yl] 4-bromanylbenzoate

Systemtic Name: [5-ethyl-2-(4-nitrophenyl)pyrazol-3-yl] 4-bromanylbenzoate Openeye Name: [5-ethyl-2-(4-nitrophenyl)pyrazol-3-yl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [5-ethyl-2-(4-nitrophenyl)-3-pyrazolyl] ester IUPAC Name: [5-ethyl-2-(4-nitrophenyl)pyrazol-3-yl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [5-ethyl-2-(4-nitrophenyl)pyrazol-3-yl] ester Formula: C18H14BrN3O4 MolecularWeight: 416.22546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14BrN3O4/c1-2-14-11-17(26-18(23)12-3-5-13(19)6-4-12)21(20-14)15-7-9-16(10-8-15)22(24)25/h3-11H,2H2,1H3