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

Systemtic Name: 1-(3-bromophenyl)-3-tert-butyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(3-bromophenyl)-3-tert-butyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(3-bromophenyl)-3-tert-butyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(3-bromophenyl)-3-tert-butyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(3-bromophenyl)-3-tert-butyl-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C17H22BrN3 MolecularWeight: 348.28068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2CCCCN=C2N(N1)C3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)(C)C1=C2CCCCN=C2N(N1)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H22BrN3/c1-17(2,3)15-14-9-4-5-10-19-16(14)21(20-15)13-8-6-7-12(18)11-13/h6-8,11,20H,4-5,9-10H2,1-3H3