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

Systemtic Name: 3-chloranyl-8-methoxy-6-(4-methylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine Openeye Name: 3-chloro-8-methoxy-6-(4-methylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine CAS Name: 3-chloro-8-methoxy-6-(4-methyl-1-piperazinyl)-5H-benzo[b][1,4]benzodiazepine IUPAC Name: 3-chloro-8-methoxy-6-(4-methylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepine Traditional Name: 3-chloro-8-methoxy-6-(4-methylpiperazino)-5H-benzo[b][1,4]benzodiazepine Formula: C19H21ClN4O MolecularWeight: 356.84924

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C3C=C(C=CC3=NC4=C(N2)C=C(C=C4)Cl)OC

Isomeric SMILES

CN1CCN(CC1)C2=C3C=C(C=CC3=NC4=C(N2)C=C(C=C4)Cl)OC

InChI

InChI=1S/C19H21ClN4O/c1-23-7-9-24(10-8-23)19-15-12-14(25-2)4-6-16(15)21-17-5-3-13(20)11-18(17)22-19/h3-6,11-12,22H,7-10H2,1-2H3