1-chloranyl-6-piperazin-1-yl-3-(trifluoromethyl)-5H-benzo[b][1,4]benzodiazepine

Systemtic Name: 1-chloranyl-6-piperazin-1-yl-3-(trifluoromethyl)-5H-benzo[b][1,4]benzodiazepine Openeye Name: 1-chloro-6-piperazin-1-yl-3-(trifluoromethyl)-5H-benzo[b][1,4]benzodiazepine CAS Name: 1-chloro-6-(1-piperazinyl)-3-(trifluoromethyl)-5H-benzo[b][1,4]benzodiazepine IUPAC Name: 1-chloro-6-piperazin-1-yl-3-(trifluoromethyl)-5H-benzo[b][1,4]benzodiazepine Traditional Name: 1-chloro-6-piperazino-3-(trifluoromethyl)-5H-benzo[b][1,4]benzodiazepine Formula: C18H16ClF3N4 MolecularWeight: 380.79465

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4Cl)C(F)(F)F

Isomeric SMILES

C1CN(CCN1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4Cl)C(F)(F)F

InChI

InChI=1S/C18H16ClF3N4/c19-13-9-11(18(20,21)22)10-15-16(13)24-14-4-2-1-3-12(14)17(25-15)26-7-5-23-6-8-26/h1-4,9-10,23,25H,5-8H2