8-chloranyl-6-(4,4-dimethylpiperazin-4-ium-1-yl)-11H-benzo[b][1,4]benzodiazepine

Systemtic Name: 8-chloranyl-6-(4,4-dimethylpiperazin-4-ium-1-yl)-11H-benzo[b][1,4]benzodiazepine Openeye Name: 8-chloro-6-(4,4-dimethylpiperazin-4-ium-1-yl)-11H-benzo[b][1,4]benzodiazepine CAS Name: 8-chloro-6-(4,4-dimethyl-1-piperazin-4-iumyl)-11H-benzo[b][1,4]benzodiazepine IUPAC Name: 8-chloro-6-(4,4-dimethylpiperazin-4-ium-1-yl)-11H-benzo[b][1,4]benzodiazepine Traditional Name: 8-chloro-6-(4,4-dimethylpiperazin-4-ium-1-yl)-11H-benzo[b][1,4]benzodiazepine Formula: C19H22ClN4+ MolecularWeight: 341.85778

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)C2=NC3=CC=CC=C3NC4=C2C=C(C=C4)Cl)C

Isomeric SMILES

C[N+]1(CCN(CC1)C2=NC3=CC=CC=C3NC4=C2C=C(C=C4)Cl)C

InChI

InChI=1S/C19H22ClN4/c1-24(2)11-9-23(10-12-24)19-15-13-14(20)7-8-16(15)21-17-5-3-4-6-18(17)22-19/h3-8,13,21H,9-12H2,1-2H3/q+1