8-bromanyl-4-(4-fluorophenyl)-2-(4-nitrophenyl)-1H-1,3,5-benzotriazepine

Systemtic Name: 8-bromanyl-4-(4-fluorophenyl)-2-(4-nitrophenyl)-1H-1,3,5-benzotriazepine Openeye Name: 8-bromo-4-(4-fluorophenyl)-2-(4-nitrophenyl)-1H-1,3,5-benzotriazepine CAS Name: 8-bromo-4-(4-fluorophenyl)-2-(4-nitrophenyl)-1H-1,3,5-benzotriazepine IUPAC Name: 8-bromo-4-(4-fluorophenyl)-2-(4-nitrophenyl)-1H-1,3,5-benzotriazepine Traditional Name: 8-bromo-4-(4-fluorophenyl)-2-(4-nitrophenyl)-1H-1,3,5-benzotriazepine Formula: C20H12BrFN4O2 MolecularWeight: 439.237283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=NC3=C(N2)C=C(C=C3)Br)C4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=NC3=C(N2)C=C(C=C3)Br)C4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C20H12BrFN4O2/c21-14-5-10-17-18(11-14)24-20(13-3-8-16(9-4-13)26(27)28)25-19(23-17)12-1-6-15(22)7-2-12/h1-11H,(H,23,24,25)