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

Systemtic Name: 1-(2-ethoxyphenyl)-3-(4-phenylphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(2-ethoxyphenyl)-3-(4-phenylphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(2-ethoxyphenyl)-3-(4-phenylphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(2-ethoxyphenyl)-3-(4-phenylphenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-o-phenetyl-3-(4-phenylphenyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C27H27N3O MolecularWeight: 409.52278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C3=NCCCCC3=C(N2)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=CC=C1N2C3=NCCCCC3=C(N2)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N3O/c1-2-31-25-14-7-6-13-24(25)30-27-23(12-8-9-19-28-27)26(29-30)22-17-15-21(16-18-22)20-10-4-3-5-11-20/h3-7,10-11,13-18,29H,2,8-9,12,19H2,1H3