3-bromanyl-11-methyl-6-piperazin-1-yl-benzo[b][1,4]benzodiazepine

Systemtic Name: 3-bromanyl-11-methyl-6-piperazin-1-yl-benzo[b][1,4]benzodiazepine Openeye Name: 3-bromo-11-methyl-6-piperazin-1-yl-benzo[b][1,4]benzodiazepine CAS Name: 3-bromo-11-methyl-6-(1-piperazinyl)benzo[b][1,4]benzodiazepine IUPAC Name: 3-bromo-11-methyl-6-piperazin-1-ylbenzo[b][1,4]benzodiazepine Traditional Name: 3-bromo-11-methyl-6-piperazino-benzo[b][1,4]benzodiazepine Formula: C18H19BrN4 MolecularWeight: 371.27426

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)Br)N=C(C3=CC=CC=C31)N4CCNCC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)Br)N=C(C3=CC=CC=C31)N4CCNCC4

InChI

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