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

Systemtic Name: 1-(4-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(4-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(4-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(4-methoxyphenyl)-3-[(3-methoxyphenyl)methyl]-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 3-m-anisyl-1-(4-methoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C22H25N3O2 MolecularWeight: 363.4528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=NCCCCC3=C(N2)CC4=CC(=CC=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=NCCCCC3=C(N2)CC4=CC(=CC=C4)OC

InChI

InChI=1S/C22H25N3O2/c1-26-18-11-9-17(10-12-18)25-22-20(8-3-4-13-23-22)21(24-25)15-16-6-5-7-19(14-16)27-2/h5-7,9-12,14,24H,3-4,8,13,15H2,1-2H3