1-piperazin-1-yl-2-[7-(trifluoromethyloxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethane-1,2-dione

Systemtic Name: 1-piperazin-1-yl-2-[7-(trifluoromethyloxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethane-1,2-dione Openeye Name: 1-piperazin-1-yl-2-[7-(trifluoromethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethane-1,2-dione CAS Name: 1-(1-piperazinyl)-2-[7-(trifluoromethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethane-1,2-dione IUPAC Name: 1-piperazin-1-yl-2-[7-(trifluoromethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethane-1,2-dione Traditional Name: 1-piperazino-2-[7-(trifluoromethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethane-1,2-dione Formula: C16H18F3N3O4 MolecularWeight: 373.32703

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C(=O)N2CCOC3=C(C2)C=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1CN(CCN1)C(=O)C(=O)N2CCOC3=C(C2)C=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C16H18F3N3O4/c17-16(18,19)26-12-1-2-13-11(9-12)10-22(7-8-25-13)15(24)14(23)21-5-3-20-4-6-21/h1-2,9,20H,3-8,10H2