7-nitro-1,3-diphenyl-pyrazolo[3,4-b][1,5]benzoxazepine

Systemtic Name: 7-nitro-1,3-diphenyl-pyrazolo[3,4-b][1,5]benzoxazepine Openeye Name: 7-nitro-1,3-diphenyl-pyrazolo[3,4-b][1,5]benzoxazepine CAS Name: 7-nitro-1,3-diphenylpyrazolo[3,4-b][1,5]benzoxazepine IUPAC Name: 7-nitro-1,3-diphenylpyrazolo[3,4-b][1,5]benzoxazepine Traditional Name: 7-nitro-1,3-diphenyl-pyrazolo[3,4-b][1,5]benzoxazepine Formula: C22H14N4O3 MolecularWeight: 382.37156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C3=C2C=NC4=C(O3)C=CC(=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C3=C2C=NC4=C(O3)C=CC(=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C22H14N4O3/c27-26(28)17-11-12-20-19(13-17)23-14-18-21(15-7-3-1-4-8-15)24-25(22(18)29-20)16-9-5-2-6-10-16/h1-14H