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

Systemtic Name: 4-[(1,3-diphenylpyrazol-4-yl)methyl]-7-pyridin-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Openeye Name: 4-[(1,3-diphenylpyrazol-4-yl)methyl]-7-(2-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol CAS Name: 4-[(1,3-diphenyl-4-pyrazolyl)methyl]-7-(2-pyridinyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol IUPAC Name: 4-[(1,3-diphenylpyrazol-4-yl)methyl]-7-pyridin-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Traditional Name: 4-[(1,3-diphenylpyrazol-4-yl)methyl]-7-(2-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Formula: C30H26N4O2 MolecularWeight: 474.55304

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(CN1CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C=C(C=C2O)C6=CC=CC=N6

Isomeric SMILES

C1COC2=C(CN1CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C=C(C=C2O)C6=CC=CC=N6

InChI

InChI=1S/C30H26N4O2/c35-28-18-23(27-13-7-8-14-31-27)17-24-19-33(15-16-36-30(24)28)20-25-21-34(26-11-5-2-6-12-26)32-29(25)22-9-3-1-4-10-22/h1-14,17-18,21,35H,15-16,19-20H2