3-[2,7-bis(oxidanylidene)azepan-1-yl]propanenitrile

Systemtic Name: 3-[2,7-bis(oxidanylidene)azepan-1-yl]propanenitrile Openeye Name: 3-(2,7-dioxoazepan-1-yl)propanenitrile CAS Name: 3-(2,7-dioxo-1-azepanyl)propanenitrile IUPAC Name: 3-(2,7-dioxoazepan-1-yl)propanenitrile Traditional Name: 3-(2,7-diketoazepan-1-yl)propionitrile Formula: C9H12N2O2 MolecularWeight: 180.20378

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(C(=O)C1)CCC#N

Isomeric SMILES

C1CCC(=O)N(C(=O)C1)CCC#N

InChI

InChI=1S/C9H12N2O2/c10-6-3-7-11-8(12)4-1-2-5-9(11)13/h1-5,7H2