[1-methyl-6-(methylamino)-7-oxidanylidene-azepan-3-yl] propanoate

Systemtic Name: [1-methyl-6-(methylamino)-7-oxidanylidene-azepan-3-yl] propanoate Openeye Name: [1-methyl-6-(methylamino)-7-oxo-azepan-3-yl] propanoate CAS Name: propanoic acid [1-methyl-6-(methylamino)-7-oxo-3-azepanyl] ester IUPAC Name: [1-methyl-6-(methylamino)-7-oxoazepan-3-yl] propanoate Traditional Name: propionic acid [7-keto-1-methyl-6-(methylamino)azepan-3-yl] ester Formula: C11H20N2O3 MolecularWeight: 228.2881

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1CCC(C(=O)N(C1)C)NC

Isomeric SMILES

CCC(=O)OC1CCC(C(=O)N(C1)C)NC

InChI

InChI=1S/C11H20N2O3/c1-4-10(14)16-8-5-6-9(12-2)11(15)13(3)7-8/h8-9,12H,4-7H2,1-3H3