4-[[4-[4-(1H-indol-3-yl)butanoyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[4-(1H-indol-3-yl)butanoyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[4-(1H-indol-3-yl)butanoyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[4-(1H-indol-3-yl)-1-oxobutyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[4-(1H-indol-3-yl)butanoyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[4-(1H-indol-3-yl)butanoyl]piperazino]methyl]benzonitrile Formula: C24H26N4O MolecularWeight: 386.48944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)CCCC3=CNC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)CCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C24H26N4O/c25-16-19-8-10-20(11-9-19)18-27-12-14-28(15-13-27)24(29)7-3-4-21-17-26-23-6-2-1-5-22(21)23/h1-2,5-6,8-11,17,26H,3-4,7,12-15,18H2