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2-[[7-oxidanylidene-4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]methyl]benzenecarbonitrile

2-[[7-oxidanylidene-4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]methyl]benzenecarbonitrile

Systemtic Name:2-[[7-oxidanylidene-4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]methyl]benzenecarbonitrile
Openeye Name:2-[[7-oxo-4-(3-pyridylmethyl)-1,4-diazepan-1-yl]methyl]benzonitrile
CAS Name:2-[[7-oxo-4-(3-pyridinylmethyl)-1,4-diazepan-1-yl]methyl]benzonitrile
IUPAC Name:2-[[7-oxo-4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]methyl]benzonitrile
Traditional Name:2-[[7-keto-4-(3-pyridylmethyl)-1,4-diazepan-1-yl]methyl]benzonitrile
Formula: C19H20N4O
MolecularWeight: 320.3883
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1=O)CC2=CC=CC=C2C#N)CC3=CN=CC=C3


Isomeric SMILES

C1CN(CCN(C1=O)CC2=CC=CC=C2C#N)CC3=CN=CC=C3


InChI

InChI=1S/C19H20N4O/c20-12-17-5-1-2-6-18(17)15-23-11-10-22(9-7-19(23)24)14-16-4-3-8-21-13-16/h1-6,8,13H,7,9-11,14-15H2


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