1-(1-acetamidoazepan-1-ium-1-yl)propan-2-olate

Systemtic Name: 1-(1-acetamidoazepan-1-ium-1-yl)propan-2-olate Openeye Name: 1-(1-acetamidoazepan-1-ium-1-yl)propan-2-olate CAS Name: 1-(1-acetamido-1-azepan-1-iumyl)-2-propanolate IUPAC Name: 1-(1-acetamidoazepan-1-ium-1-yl)propan-2-olate Traditional Name: 1-(1-acetamidoazepan-1-ium-1-yl)propan-2-olate Formula: C11H22N2O2 MolecularWeight: 214.30458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[N+]1(CCCCCC1)NC(=O)C)[O-]

Isomeric SMILES

CC(C[N+]1(CCCCCC1)NC(=O)C)[O-]

InChI

InChI=1S/C11H22N2O2/c1-10(14)9-13(12-11(2)15)7-5-3-4-6-8-13/h10H,3-9H2,1-2H3,(H,12,15)