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

Systemtic Name: 3-chloranyl-6-(3-phenylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine Openeye Name: 3-chloro-6-(3-phenylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine CAS Name: 3-chloro-6-(3-phenyl-1-piperazinyl)-5H-benzo[b][1,4]benzodiazepine IUPAC Name: 3-chloro-6-(3-phenylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine Traditional Name: 3-chloro-6-(3-phenylpiperazino)-5H-benzo[b][1,4]benzodiazepine Formula: C23H21ClN4 MolecularWeight: 388.89264

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)C2=CC=CC=C2)C3=C4C=CC=CC4=NC5=C(N3)C=C(C=C5)Cl

Isomeric SMILES

C1CN(CC(N1)C2=CC=CC=C2)C3=C4C=CC=CC4=NC5=C(N3)C=C(C=C5)Cl

InChI

InChI=1S/C23H21ClN4/c24-17-10-11-20-21(14-17)27-23(18-8-4-5-9-19(18)26-20)28-13-12-25-22(15-28)16-6-2-1-3-7-16/h1-11,14,22,25,27H,12-13,15H2