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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=C2CCCCN=C2N(N1)C3=CC=CC=C3Br

Isomeric SMILES

CCC(CC)C1=C2CCCCN=C2N(N1)C3=CC=CC=C3Br

InChI

InChI=1S/C18H24BrN3/c1-3-13(4-2)17-14-9-7-8-12-20-18(14)22(21-17)16-11-6-5-10-15(16)19/h5-6,10-11,13,21H,3-4,7-9,12H2,1-2H3