3-[[4-[2-(cycloheptylamino)ethyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[4-[2-(cycloheptylamino)ethyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[4-[2-(cycloheptylamino)ethyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 3-[[4-[2-(cycloheptylamino)ethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 3-[[4-[2-(cycloheptylamino)ethyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 3-[[4-[2-(cycloheptylamino)ethyl]piperazino]methyl]benzonitrile Formula: C21H32N4 MolecularWeight: 340.50558

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NCCN2CCN(CC2)CC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CCCC(CC1)NCCN2CCN(CC2)CC3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H32N4/c22-17-19-6-5-7-20(16-19)18-25-14-12-24(13-15-25)11-10-23-21-8-3-1-2-4-9-21/h5-7,16,21,23H,1-4,8-15,18H2