2-methyl-N-propan-2-yl-4-[3-(trifluoromethyl)benzo[b][1,4]benzoxazepin-6-yl]piperazine-1-carboxamide

Systemtic Name: 2-methyl-N-propan-2-yl-4-[3-(trifluoromethyl)benzo[b][1,4]benzoxazepin-6-yl]piperazine-1-carboxamide Openeye Name: N-isopropyl-2-methyl-4-[3-(trifluoromethyl)benzo[b][1,4]benzoxazepin-6-yl]piperazine-1-carboxamide CAS Name: 2-methyl-N-propan-2-yl-4-[3-(trifluoromethyl)-6-benzo[b][1,4]benzoxazepinyl]-1-piperazinecarboxamide IUPAC Name: 2-methyl-N-propan-2-yl-4-[3-(trifluoromethyl)benzo[b][1,4]benzoxazepin-6-yl]piperazine-1-carboxamide Traditional Name: N-isopropyl-2-methyl-4-[3-(trifluoromethyl)benzo[b][1,4]benzoxazepin-6-yl]piperazine-1-carboxamide Formula: C23H25F3N4O2 MolecularWeight: 446.46541

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)NC(C)C)C2=NC3=C(C=CC(=C3)C(F)(F)F)OC4=CC=CC=C42

Isomeric SMILES

CC1CN(CCN1C(=O)NC(C)C)C2=NC3=C(C=CC(=C3)C(F)(F)F)OC4=CC=CC=C42

InChI

InChI=1S/C23H25F3N4O2/c1-14(2)27-22(31)30-11-10-29(13-15(30)3)21-17-6-4-5-7-19(17)32-20-9-8-16(23(24,25)26)12-18(20)28-21/h4-9,12,14-15H,10-11,13H2,1-3H3,(H,27,31)