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

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,5-dimethylphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,5-dimethylphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,5-dimethylphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,5-dimethylphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,5-dimethylphenyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C23H25N3O2 MolecularWeight: 375.4635

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=C3CCCCN=C3N(N2)C4=CC5=C(C=C4)OCCO5)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C3CCCCN=C3N(N2)C4=CC5=C(C=C4)OCCO5)C

InChI

InChI=1S/C23H25N3O2/c1-15-11-16(2)13-17(12-15)22-19-5-3-4-8-24-23(19)26(25-22)18-6-7-20-21(14-18)28-10-9-27-20/h6-7,11-14,25H,3-5,8-10H2,1-2H3