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

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,6-dimethoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,6-dimethoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,6-dimethoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,6-dimethoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,6-dimethoxyphenyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C2=C3CCCCN=C3N(N2)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C2=C3CCCCN=C3N(N2)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C23H25N3O4/c1-27-18-7-5-8-19(28-2)21(18)22-16-6-3-4-11-24-23(16)26(25-22)15-9-10-17-20(14-15)30-13-12-29-17/h5,7-10,14,25H,3-4,6,11-13H2,1-2H3