2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-4-methyl-pentanoate

Systemtic Name: 2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-4-methyl-pentanoate Openeye Name: 2-[2-(azepan-1-yl)-2-oxo-ethyl]-4-methyl-pentanoate CAS Name: 2-[2-(1-azepanyl)-2-oxoethyl]-4-methylpentanoate IUPAC Name: 2-[2-(azepan-1-yl)-2-oxoethyl]-4-methylpentanoate Traditional Name: 2-[2-(azepan-1-yl)-2-keto-ethyl]-4-methyl-valerate Formula: C14H24NO3- MolecularWeight: 254.34526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)N1CCCCCC1)C(=O)[O-]

Isomeric SMILES

CC(C)CC(CC(=O)N1CCCCCC1)C(=O)[O-]

InChI

InChI=1S/C14H25NO3/c1-11(2)9-12(14(17)18)10-13(16)15-7-5-3-4-6-8-15/h11-12H,3-10H2,1-2H3,(H,17,18)/p-1