3-[[4-(1,4-diazepan-1-yl)piperidin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[4-(1,4-diazepan-1-yl)piperidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[4-(1,4-diazepan-1-yl)-1-piperidyl]methyl]benzonitrile CAS Name: 3-[[4-(1,4-diazepan-1-yl)-1-piperidinyl]methyl]benzonitrile IUPAC Name: 3-[[4-(1,4-diazepan-1-yl)piperidin-1-yl]methyl]benzonitrile Traditional Name: 3-[[4-(1,4-diazepan-1-yl)piperidino]methyl]benzonitrile Formula: C18H26N4 MolecularWeight: 298.42584

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2CCN(CC2)CC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CNCCN(C1)C2CCN(CC2)CC3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H26N4/c19-14-16-3-1-4-17(13-16)15-21-10-5-18(6-11-21)22-9-2-7-20-8-12-22/h1,3-4,13,18,20H,2,5-12,15H2