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

Systemtic Name: 3-chloranyl-6-(3-methylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine Openeye Name: 3-chloro-6-(3-methylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine CAS Name: 3-chloro-6-(3-methyl-1-piperazinyl)-5H-benzo[b][1,4]benzodiazepine IUPAC Name: 3-chloro-6-(3-methylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine Traditional Name: 3-chloro-6-(3-methylpiperazino)-5H-benzo[b][1,4]benzodiazepine Formula: C18H19ClN4 MolecularWeight: 326.82326

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4)Cl

Isomeric SMILES

CC1CN(CCN1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4)Cl

InChI

InChI=1S/C18H19ClN4/c1-12-11-23(9-8-20-12)18-14-4-2-3-5-15(14)21-16-7-6-13(19)10-17(16)22-18/h2-7,10,12,20,22H,8-9,11H2,1H3