2-[3-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzazepin-11-yl]ethanenitrile

Systemtic Name: 2-[3-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzazepin-11-yl]ethanenitrile Openeye Name: 2-[3-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzazepin-11-yl]acetonitrile CAS Name: 2-[3-(4-methyl-1-piperazinyl)-5,6-dihydrobenzo[b][1]benzazepin-11-yl]acetonitrile IUPAC Name: 2-[3-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzazepin-11-yl]acetonitrile Traditional Name: 2-[3-(4-methylpiperazino)-5,6-dihydrobenzo[b][1]benzazepin-11-yl]acetonitrile Formula: C21H24N4 MolecularWeight: 332.44206

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=C(C=C2)N(C4=CC=CC=C4CC3)CC#N

Isomeric SMILES

CN1CCN(CC1)C2=CC3=C(C=C2)N(C4=CC=CC=C4CC3)CC#N

InChI

InChI=1S/C21H24N4/c1-23-12-14-24(15-13-23)19-8-9-21-18(16-19)7-6-17-4-2-3-5-20(17)25(21)11-10-22/h2-5,8-9,16H,6-7,11-15H2,1H3