4-[[4-[3-(1H-indol-3-yl)propanoyl]-1,4-diazepan-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[3-(1H-indol-3-yl)propanoyl]-1,4-diazepan-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[3-(1H-indol-3-yl)propanoyl]-1,4-diazepan-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[3-(1H-indol-3-yl)-1-oxopropyl]-1,4-diazepan-1-yl]methyl]benzonitrile IUPAC Name: 4-[[4-[3-(1H-indol-3-yl)propanoyl]-1,4-diazepan-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[3-(1H-indol-3-yl)propanoyl]-1,4-diazepan-1-yl]methyl]benzonitrile Formula: C24H26N4O MolecularWeight: 386.48944

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)CCC2=CNC3=CC=CC=C32)CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCN(C1)C(=O)CCC2=CNC3=CC=CC=C32)CC4=CC=C(C=C4)C#N

InChI

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