[(2S)-8-methoxy-2-methyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-[2-methyl-5-(2-methylpropyl)pyrazol-3-yl]methanone

Systemtic Name: [(2S)-8-methoxy-2-methyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-[2-methyl-5-(2-methylpropyl)pyrazol-3-yl]methanone Openeye Name: (5-isobutyl-2-methyl-pyrazol-3-yl)-[(2S)-8-methoxy-2-methyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone CAS Name: [(2S)-8-methoxy-2-methyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-[2-methyl-5-(2-methylpropyl)-3-pyrazolyl]methanone IUPAC Name: [(2S)-8-methoxy-2-methyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-[2-methyl-5-(2-methylpropyl)pyrazol-3-yl]methanone Traditional Name: (5-isobutyl-2-methyl-pyrazol-3-yl)-[(2S)-8-methoxy-2-methyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC2=C(O1)C=C(C=C2)OC)C(=O)C3=CC(=NN3C)CC(C)C

Isomeric SMILES

C[C@H]1CN(CC2=C(O1)C=C(C=C2)OC)C(=O)C3=CC(=NN3C)CC(C)C

InChI

InChI=1S/C20H27N3O3/c1-13(2)8-16-9-18(22(4)21-16)20(24)23-11-14(3)26-19-10-17(25-5)7-6-15(19)12-23/h6-7,9-10,13-14H,8,11-12H2,1-5H3/t14-/m0/s1