methyl 3-(3-oxidanylidenepiperazin-1-ium-1-yl)propanoate

Systemtic Name: methyl 3-(3-oxidanylidenepiperazin-1-ium-1-yl)propanoate Openeye Name: methyl 3-(3-oxopiperazin-1-ium-1-yl)propanoate CAS Name: 3-(3-oxo-1-piperazin-1-iumyl)propanoic acid methyl ester IUPAC Name: methyl 3-(3-oxopiperazin-1-ium-1-yl)propanoate Traditional Name: 3-(3-ketopiperazin-1-ium-1-yl)propionic acid methyl ester Formula: C8H15N2O3+ MolecularWeight: 187.2163

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC[NH+]1CCNC(=O)C1

Isomeric SMILES

COC(=O)CC[NH+]1CCNC(=O)C1

InChI

InChI=1S/C8H14N2O3/c1-13-8(12)2-4-10-5-3-9-7(11)6-10/h2-6H2,1H3,(H,9,11)/p+1