3-chloranyl-8-methoxy-6-piperazin-1-yl-5H-benzo[b][1,4]benzodiazepine

Systemtic Name: 3-chloranyl-8-methoxy-6-piperazin-1-yl-5H-benzo[b][1,4]benzodiazepine Openeye Name: 3-chloro-8-methoxy-6-piperazin-1-yl-5H-benzo[b][1,4]benzodiazepine CAS Name: 3-chloro-8-methoxy-6-(1-piperazinyl)-5H-benzo[b][1,4]benzodiazepine IUPAC Name: 3-chloro-8-methoxy-6-piperazin-1-yl-5H-benzo[b][1,4]benzodiazepine Traditional Name: 3-chloro-8-methoxy-6-piperazino-5H-benzo[b][1,4]benzodiazepine Formula: C18H19ClN4O MolecularWeight: 342.82266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(NC3=C(C=CC(=C3)Cl)N=C2C=C1)N4CCNCC4

Isomeric SMILES

COC1=CC2=C(NC3=C(C=CC(=C3)Cl)N=C2C=C1)N4CCNCC4

InChI

InChI=1S/C18H19ClN4O/c1-24-13-3-5-15-14(11-13)18(23-8-6-20-7-9-23)22-17-10-12(19)2-4-16(17)21-15/h2-5,10-11,20,22H,6-9H2,1H3