1-(3-but-3-enyl-2-oxidanylidene-azepan-1-yl)butane-1,3-dione

Systemtic Name: 1-(3-but-3-enyl-2-oxidanylidene-azepan-1-yl)butane-1,3-dione Openeye Name: 1-(3-but-3-enyl-2-oxo-azepan-1-yl)butane-1,3-dione CAS Name: 1-(3-but-3-enyl-2-oxo-1-azepanyl)butane-1,3-dione IUPAC Name: 1-(3-but-3-enyl-2-oxoazepan-1-yl)butane-1,3-dione Traditional Name: 1-(3-but-3-enyl-2-keto-azepan-1-yl)butane-1,3-dione Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)N1CCCCC(C1=O)CCC=C

Isomeric SMILES

CC(=O)CC(=O)N1CCCCC(C1=O)CCC=C

InChI

InChI=1S/C14H21NO3/c1-3-4-7-12-8-5-6-9-15(14(12)18)13(17)10-11(2)16/h3,12H,1,4-10H2,2H3