8-bromanyl-6-piperazin-1-yl-3-(trifluoromethyl)benzo[b][1,4]benzoxazepine

Systemtic Name: 8-bromanyl-6-piperazin-1-yl-3-(trifluoromethyl)benzo[b][1,4]benzoxazepine Openeye Name: 8-bromo-6-piperazin-1-yl-3-(trifluoromethyl)benzo[b][1,4]benzoxazepine CAS Name: 8-bromo-6-(1-piperazinyl)-3-(trifluoromethyl)benzo[b][1,4]benzoxazepine IUPAC Name: 8-bromo-6-piperazin-1-yl-3-(trifluoromethyl)benzo[b][1,4]benzoxazepine Traditional Name: 8-bromo-6-piperazino-3-(trifluoromethyl)benzo[b][1,4]benzoxazepine Formula: C18H15BrF3N3O MolecularWeight: 426.23041

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC3=C(C=CC(=C3)C(F)(F)F)OC4=C2C=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1)C2=NC3=C(C=CC(=C3)C(F)(F)F)OC4=C2C=C(C=C4)Br

InChI

InChI=1S/C18H15BrF3N3O/c19-12-2-4-15-13(10-12)17(25-7-5-23-6-8-25)24-14-9-11(18(20,21)22)1-3-16(14)26-15/h1-4,9-10,23H,5-8H2