1-[2-chloranyl-9-(trifluoromethyl)benzo[b][1]benzoxepin-6-yl]-4-methyl-piperazine

Systemtic Name: 1-[2-chloranyl-9-(trifluoromethyl)benzo[b][1]benzoxepin-6-yl]-4-methyl-piperazine Openeye Name: 1-[2-chloro-9-(trifluoromethyl)benzo[b][1]benzoxepin-6-yl]-4-methyl-piperazine CAS Name: 1-[2-chloro-9-(trifluoromethyl)-6-benzo[b][1]benzoxepinyl]-4-methylpiperazine IUPAC Name: 1-[2-chloro-9-(trifluoromethyl)benzo[b][1]benzoxepin-6-yl]-4-methylpiperazine Traditional Name: 1-[2-chloro-9-(trifluoromethyl)benzo[b][1]benzoxepin-6-yl]-4-methyl-piperazine Formula: C20H18ClF3N2O MolecularWeight: 394.81793

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=C(C=C(C=C3)Cl)OC4=C2C=CC(=C4)C(F)(F)F

Isomeric SMILES

CN1CCN(CC1)C2=CC3=C(C=C(C=C3)Cl)OC4=C2C=CC(=C4)C(F)(F)F

InChI

InChI=1S/C20H18ClF3N2O/c1-25-6-8-26(9-7-25)17-10-13-2-4-15(21)12-18(13)27-19-11-14(20(22,23)24)3-5-16(17)19/h2-5,10-12H,6-9H2,1H3