1-(4-bromophenyl)-3-(4-iodophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine

Systemtic Name: 1-(4-bromophenyl)-3-(4-iodophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(4-bromophenyl)-3-(4-iodophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(4-bromophenyl)-3-(4-iodophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(4-bromophenyl)-3-(4-iodophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(4-bromophenyl)-3-(4-iodophenyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C19H17BrIN3 MolecularWeight: 494.16685

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN=C2C(=C(NN2C3=CC=C(C=C3)Br)C4=CC=C(C=C4)I)C1

Isomeric SMILES

C1CCN=C2C(=C(NN2C3=CC=C(C=C3)Br)C4=CC=C(C=C4)I)C1

InChI

InChI=1S/C19H17BrIN3/c20-14-6-10-16(11-7-14)24-19-17(3-1-2-12-22-19)18(23-24)13-4-8-15(21)9-5-13/h4-11,23H,1-3,12H2