4-[[4-(3H-benzo[e]indol-2-ylcarbonyl)piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(3H-benzo[e]indol-2-ylcarbonyl)piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(3H-benzo[e]indole-2-carbonyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[3H-benzo[e]indol-2-yl(oxo)methyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(3H-benzo[e]indole-2-carbonyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(3H-benz[e]indole-2-carbonyl)piperazino]methyl]benzonitrile Formula: C25H22N4O MolecularWeight: 394.46838

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=CC4=C(N3)C=CC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=CC4=C(N3)C=CC5=CC=CC=C54

InChI

InChI=1S/C25H22N4O/c26-16-18-5-7-19(8-6-18)17-28-11-13-29(14-12-28)25(30)24-15-22-21-4-2-1-3-20(21)9-10-23(22)27-24/h1-10,15,27H,11-14,17H2