1-(9-methoxy-7-quinolin-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-(5-methylpyrazol-1-yl)ethanone

Systemtic Name: 1-(9-methoxy-7-quinolin-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-(5-methylpyrazol-1-yl)ethanone Openeye Name: 1-[9-methoxy-7-(3-quinolyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-(5-methylpyrazol-1-yl)ethanone CAS Name: 1-[9-methoxy-7-(3-quinolinyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-(5-methyl-1-pyrazolyl)ethanone IUPAC Name: 1-(9-methoxy-7-quinolin-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-(5-methylpyrazol-1-yl)ethanone Traditional Name: 1-[9-methoxy-7-(3-quinolyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-(5-methylpyrazol-1-yl)ethanone Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NN1CC(=O)N2CCOC3=C(C2)C=C(C=C3OC)C4=CC5=CC=CC=C5N=C4

Isomeric SMILES

CC1=CC=NN1CC(=O)N2CCOC3=C(C2)C=C(C=C3OC)C4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C25H24N4O3/c1-17-7-8-27-29(17)16-24(30)28-9-10-32-25-21(15-28)12-19(13-23(25)31-2)20-11-18-5-3-4-6-22(18)26-14-20/h3-8,11-14H,9-10,15-16H2,1-2H3