3-[[1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]-methyl-amino]propanenitrile

Systemtic Name: 3-[[1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]-methyl-amino]propanenitrile Openeye Name: 3-[[2-(azepan-1-yl)-1-methyl-2-oxo-ethyl]-methyl-amino]propanenitrile CAS Name: 3-[[1-(1-azepanyl)-1-oxopropan-2-yl]-methylamino]propanenitrile IUPAC Name: 3-[[1-(azepan-1-yl)-1-oxopropan-2-yl]-methylamino]propanenitrile Traditional Name: 3-[[2-(azepan-1-yl)-2-keto-1-methyl-ethyl]-methyl-amino]propionitrile Formula: C13H23N3O MolecularWeight: 237.34122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)N(C)CCC#N

Isomeric SMILES

CC(C(=O)N1CCCCCC1)N(C)CCC#N

InChI

InChI=1S/C13H23N3O/c1-12(15(2)9-7-8-14)13(17)16-10-5-3-4-6-11-16/h12H,3-7,9-11H2,1-2H3