benzotriazol-1-yl-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methanone

Systemtic Name: benzotriazol-1-yl-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methanone Openeye Name: benzotriazol-1-yl-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methanone CAS Name: 1-benzotriazolyl-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]methanone IUPAC Name: benzotriazol-1-yl-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]methanone Traditional Name: benzotriazol-1-yl-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methanone Formula: C22H14N6O3 MolecularWeight: 410.38496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)N4C5=CC=CC=C5N=N4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)N4C5=CC=CC=C5N=N4

InChI

InChI=1S/C22H14N6O3/c29-22(27-20-9-5-4-8-19(20)23-25-27)18-14-26(16-6-2-1-3-7-16)24-21(18)15-10-12-17(13-11-15)28(30)31/h1-14H