3-bromanyl-11-methyl-7-piperazin-1-yl-benzo[b][1,4]benzodiazepine

Systemtic Name: 3-bromanyl-11-methyl-7-piperazin-1-yl-benzo[b][1,4]benzodiazepine Openeye Name: 3-bromo-11-methyl-7-piperazin-1-yl-benzo[b][1,4]benzodiazepine CAS Name: 3-bromo-11-methyl-7-(1-piperazinyl)benzo[b][1,4]benzodiazepine IUPAC Name: 3-bromo-11-methyl-7-piperazin-1-ylbenzo[b][1,4]benzodiazepine Traditional Name: 3-bromo-11-methyl-7-piperazino-benzo[b][1,4]benzodiazepine Formula: C18H19BrN4 MolecularWeight: 371.27426

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=NC3=C1C=CC(=C3)Br)C(=CC=C2)N4CCNCC4

Isomeric SMILES

CN1C2=C(C=NC3=C1C=CC(=C3)Br)C(=CC=C2)N4CCNCC4

InChI

InChI=1S/C18H19BrN4/c1-22-16-3-2-4-17(23-9-7-20-8-10-23)14(16)12-21-15-11-13(19)5-6-18(15)22/h2-6,11-12,20H,7-10H2,1H3