4-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol

Systemtic Name: 4-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Openeye Name: 4-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-7-(3-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol CAS Name: 4-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-7-(3-pyridinyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol IUPAC Name: 4-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Traditional Name: 4-[[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-7-(3-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C=NN2)CN3CCOC4=C(C3)C=C(C=C4O)C5=CN=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C=NN2)CN3CCOC4=C(C3)C=C(C=C4O)C5=CN=CC=C5

InChI

InChI=1S/C25H24N4O3/c1-31-22-6-4-17(5-7-22)24-21(14-27-28-24)16-29-9-10-32-25-20(15-29)11-19(12-23(25)30)18-3-2-8-26-13-18/h2-8,11-14,30H,9-10,15-16H2,1H3,(H,27,28)