methyl 2-(2-oxidanylidenepiperazin-4-ium-1-yl)ethanoate

Systemtic Name: methyl 2-(2-oxidanylidenepiperazin-4-ium-1-yl)ethanoate Openeye Name: methyl 2-(2-oxopiperazin-4-ium-1-yl)acetate CAS Name: 2-(2-oxo-1-piperazin-4-iumyl)acetic acid methyl ester IUPAC Name: methyl 2-(2-oxopiperazin-4-ium-1-yl)acetate Traditional Name: 2-(2-ketopiperazin-4-ium-1-yl)acetic acid methyl ester Formula: C7H13N2O3+ MolecularWeight: 173.18972

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1CC[NH2+]CC1=O

Isomeric SMILES

COC(=O)CN1CC[NH2+]CC1=O

InChI

InChI=1S/C7H12N2O3/c1-12-7(11)5-9-3-2-8-4-6(9)10/h8H,2-5H2,1H3/p+1