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

Systemtic Name: 3-(3,5-dimethoxyphenyl)-1-(2-methoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 3-(3,5-dimethoxyphenyl)-1-(2-methoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 3-(3,5-dimethoxyphenyl)-1-(2-methoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 3-(3,5-dimethoxyphenyl)-1-(2-methoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 3-(3,5-dimethoxyphenyl)-1-(2-methoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C3=NCCCCC3=C(N2)C4=CC(=CC(=C4)OC)OC

Isomeric SMILES

COC1=CC=CC=C1N2C3=NCCCCC3=C(N2)C4=CC(=CC(=C4)OC)OC

InChI

InChI=1S/C22H25N3O3/c1-26-16-12-15(13-17(14-16)27-2)21-18-8-6-7-11-23-22(18)25(24-21)19-9-4-5-10-20(19)28-3/h4-5,9-10,12-14,24H,6-8,11H2,1-3H3