2-oxidanylidene-2-(4-propan-2-ylpiperazin-4-ium-1-yl)ethanoate

Systemtic Name: 2-oxidanylidene-2-(4-propan-2-ylpiperazin-4-ium-1-yl)ethanoate Openeye Name: 2-(4-isopropylpiperazin-4-ium-1-yl)-2-oxo-acetate CAS Name: 2-oxo-2-(4-propan-2-yl-1-piperazin-4-iumyl)acetate IUPAC Name: 2-oxo-2-(4-propan-2-ylpiperazin-4-ium-1-yl)acetate Traditional Name: 2-(4-isopropylpiperazin-4-ium-1-yl)-2-keto-acetate Formula: C9H16N2O3 MolecularWeight: 200.23494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCN(CC1)C(=O)C(=O)[O-]

Isomeric SMILES

CC(C)[NH+]1CCN(CC1)C(=O)C(=O)[O-]

InChI

InChI=1S/C9H16N2O3/c1-7(2)10-3-5-11(6-4-10)8(12)9(13)14/h7H,3-6H2,1-2H3,(H,13,14)