(4-benzo[b][1,4]benzoxazepin-6-yl-2-methyl-piperazin-1-yl)-(3-fluorophenyl)methanone

Systemtic Name: (4-benzo[b][1,4]benzoxazepin-6-yl-2-methyl-piperazin-1-yl)-(3-fluorophenyl)methanone Openeye Name: (4-benzo[b][1,4]benzoxazepin-6-yl-2-methyl-piperazin-1-yl)-(3-fluorophenyl)methanone CAS Name: [4-(6-benzo[b][1,4]benzoxazepinyl)-2-methyl-1-piperazinyl]-(3-fluorophenyl)methanone IUPAC Name: (4-benzo[b][1,4]benzoxazepin-6-yl-2-methylpiperazin-1-yl)-(3-fluorophenyl)methanone Traditional Name: (4-benzo[b][1,4]benzoxazepin-6-yl-2-methyl-piperazino)-(3-fluorophenyl)methanone Formula: C25H22FN3O2 MolecularWeight: 415.459483

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CC(=CC=C2)F)C3=NC4=CC=CC=C4OC5=CC=CC=C53

Isomeric SMILES

CC1CN(CCN1C(=O)C2=CC(=CC=C2)F)C3=NC4=CC=CC=C4OC5=CC=CC=C53

InChI

InChI=1S/C25H22FN3O2/c1-17-16-28(13-14-29(17)25(30)18-7-6-8-19(26)15-18)24-20-9-2-4-11-22(20)31-23-12-5-3-10-21(23)27-24/h2-12,15,17H,13-14,16H2,1H3