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

Systemtic Name: 6-(4-methylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepin-3-ol Openeye Name: 6-(4-methylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepin-3-ol CAS Name: 6-(4-methyl-1-piperazinyl)-5H-benzo[b][1,4]benzodiazepin-3-ol IUPAC Name: 6-(4-methylpiperazin-1-yl)-5H-benzo[b][1,4]benzodiazepin-3-ol Traditional Name: 6-(4-methylpiperazino)-5H-benzo[b][1,4]benzodiazepin-3-ol Formula: C18H20N4O MolecularWeight: 308.3776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4)O

Isomeric SMILES

CN1CCN(CC1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4)O

InChI

InChI=1S/C18H20N4O/c1-21-8-10-22(11-9-21)18-14-4-2-3-5-15(14)19-16-7-6-13(23)12-17(16)20-18/h2-7,12,20,23H,8-11H2,1H3