1-(azepan-1-yl)-3-methyl-but-2-en-1-one

Systemtic Name: 1-(azepan-1-yl)-3-methyl-but-2-en-1-one Openeye Name: 1-(azepan-1-yl)-3-methyl-but-2-en-1-one CAS Name: 1-(1-azepanyl)-3-methyl-2-buten-1-one IUPAC Name: 1-(azepan-1-yl)-3-methylbut-2-en-1-one Traditional Name: 1-(azepan-1-yl)-3-methyl-but-2-en-1-one Formula: C11H19NO MolecularWeight: 181.27466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCCCCC1)C

Isomeric SMILES

CC(=CC(=O)N1CCCCCC1)C

InChI

InChI=1S/C11H19NO/c1-10(2)9-11(13)12-7-5-3-4-6-8-12/h9H,3-8H2,1-2H3