2-[3-(dibutylamino)-2-oxidanylidene-azepan-1-yl]propanenitrile

Systemtic Name: 2-[3-(dibutylamino)-2-oxidanylidene-azepan-1-yl]propanenitrile Openeye Name: 2-[3-(dibutylamino)-2-oxo-azepan-1-yl]propanenitrile CAS Name: 2-[3-(dibutylamino)-2-oxo-1-azepanyl]propanenitrile IUPAC Name: 2-[3-(dibutylamino)-2-oxoazepan-1-yl]propanenitrile Traditional Name: 2-[3-(dibutylamino)-2-keto-azepan-1-yl]propionitrile Formula: C17H31N3O MolecularWeight: 293.44754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1CCCCN(C1=O)C(C)C#N

Isomeric SMILES

CCCCN(CCCC)C1CCCCN(C1=O)C(C)C#N

InChI

InChI=1S/C17H31N3O/c1-4-6-11-19(12-7-5-2)16-10-8-9-13-20(17(16)21)15(3)14-18/h15-16H,4-13H2,1-3H3