2-(2-oxidanylidene-4-prop-1-ynyl-azepan-1-yl)butanamide

Systemtic Name: 2-(2-oxidanylidene-4-prop-1-ynyl-azepan-1-yl)butanamide Openeye Name: 2-(2-oxo-4-prop-1-ynyl-azepan-1-yl)butanamide CAS Name: 2-(2-oxo-4-prop-1-ynyl-1-azepanyl)butanamide IUPAC Name: 2-(2-oxo-4-prop-1-ynylazepan-1-yl)butanamide Traditional Name: 2-(2-keto-4-prop-1-ynyl-azepan-1-yl)butyramide Formula: C13H20N2O2 MolecularWeight: 236.3101

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N)N1CCCC(CC1=O)C#CC

Isomeric SMILES

CCC(C(=O)N)N1CCCC(CC1=O)C#CC

InChI

InChI=1S/C13H20N2O2/c1-3-6-10-7-5-8-15(12(16)9-10)11(4-2)13(14)17/h10-11H,4-5,7-9H2,1-2H3,(H2,14,17)