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

Systemtic Name: 1-(3-bromophenyl)-3-propyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(3-bromophenyl)-3-propyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(3-bromophenyl)-3-propyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(3-bromophenyl)-3-propyl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(3-bromophenyl)-3-propyl-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C16H20BrN3 MolecularWeight: 334.2541

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2CCCCN=C2N(N1)C3=CC(=CC=C3)Br

Isomeric SMILES

CCCC1=C2CCCCN=C2N(N1)C3=CC(=CC=C3)Br

InChI

InChI=1S/C16H20BrN3/c1-2-6-15-14-9-3-4-10-18-16(14)20(19-15)13-8-5-7-12(17)11-13/h5,7-8,11,19H,2-4,6,9-10H2,1H3