ethyl 4-[[1-(4-bromophenyl)-3,5-dimethyl-pyrazol-4-yl]diazenyl]benzoate

Systemtic Name: ethyl 4-[[1-(4-bromophenyl)-3,5-dimethyl-pyrazol-4-yl]diazenyl]benzoate Openeye Name: ethyl 4-[1-(4-bromophenyl)-3,5-dimethyl-pyrazol-4-yl]azobenzoate CAS Name: 4-[[1-(4-bromophenyl)-3,5-dimethyl-4-pyrazolyl]azo]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[1-(4-bromophenyl)-3,5-dimethylpyrazol-4-yl]diazenyl]benzoate Traditional Name: 4-[1-(4-bromophenyl)-3,5-dimethyl-pyrazol-4-yl]azobenzoic acid ethyl ester Formula: C20H19BrN4O2 MolecularWeight: 427.29446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=NC2=C(N(N=C2C)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=NC2=C(N(N=C2C)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C20H19BrN4O2/c1-4-27-20(26)15-5-9-17(10-6-15)22-23-19-13(2)24-25(14(19)3)18-11-7-16(21)8-12-18/h5-12H,4H2,1-3H3