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

Systemtic Name: 1-(3-bromophenyl)-3-pentan-3-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(3-bromophenyl)-3-(1-ethylpropyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(3-bromophenyl)-3-pentan-3-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(3-bromophenyl)-3-pentan-3-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(3-bromophenyl)-3-(1-ethylpropyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C18H24BrN3 MolecularWeight: 362.30726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24BrN3/c1-3-13(4-2)17-16-10-5-6-11-20-18(16)22(21-17)15-9-7-8-14(19)12-15/h7-9,12-13,21H,3-6,10-11H2,1-2H3