2-methoxyethyl 2-[(2S)-3-oxidanylidenepiperazin-1-ium-2-yl]ethanoate

Systemtic Name: 2-methoxyethyl 2-[(2S)-3-oxidanylidenepiperazin-1-ium-2-yl]ethanoate Openeye Name: 2-methoxyethyl 2-[(2S)-3-oxopiperazin-1-ium-2-yl]acetate CAS Name: 2-[(2S)-3-oxo-2-piperazin-1-iumyl]acetic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 2-[(2S)-3-oxopiperazin-1-ium-2-yl]acetate Traditional Name: 2-[(2S)-3-ketopiperazin-1-ium-2-yl]acetic acid 2-methoxyethyl ester Formula: C9H17N2O4+ MolecularWeight: 217.24228

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)CC1C(=O)NCC[NH2+]1

Isomeric SMILES

COCCOC(=O)C[C@H]1C(=O)NCC[NH2+]1

InChI

InChI=1S/C9H16N2O4/c1-14-4-5-15-8(12)6-7-9(13)11-3-2-10-7/h7,10H,2-6H2,1H3,(H,11,13)/p+1/t7-/m0/s1