3-[7-azanylidene-1-(furan-2-yl)azepan-2-yl]propanenitrile

Systemtic Name: 3-[7-azanylidene-1-(furan-2-yl)azepan-2-yl]propanenitrile Openeye Name: 3-[1-(2-furyl)-7-imino-azepan-2-yl]propanenitrile CAS Name: 3-[1-(2-furanyl)-7-imino-2-azepanyl]propanenitrile IUPAC Name: 3-[1-(furan-2-yl)-7-iminoazepan-2-yl]propanenitrile Traditional Name: 3-[1-(2-furyl)-7-imino-azepan-2-yl]propionitrile Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=N)N(C(C1)CCC#N)C2=CC=CO2

Isomeric SMILES

C1CCC(=N)N(C(C1)CCC#N)C2=CC=CO2

InChI

InChI=1S/C13H17N3O/c14-9-3-6-11-5-1-2-7-12(15)16(11)13-8-4-10-17-13/h4,8,10-11,15H,1-3,5-7H2