methyl 2-[(3R)-3-methyl-2-oxidanylidene-piperazin-4-ium-1-yl]ethanoate

Systemtic Name: methyl 2-[(3R)-3-methyl-2-oxidanylidene-piperazin-4-ium-1-yl]ethanoate Openeye Name: methyl 2-[(3R)-3-methyl-2-oxo-piperazin-4-ium-1-yl]acetate CAS Name: 2-[(3R)-3-methyl-2-oxo-1-piperazin-4-iumyl]acetic acid methyl ester IUPAC Name: methyl 2-[(3R)-3-methyl-2-oxopiperazin-4-ium-1-yl]acetate Traditional Name: 2-[(3R)-2-keto-3-methyl-piperazin-4-ium-1-yl]acetic acid methyl ester Formula: C8H15N2O3+ MolecularWeight: 187.2163

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC[NH2+]1)CC(=O)OC

Isomeric SMILES

C[C@@H]1C(=O)N(CC[NH2+]1)CC(=O)OC

InChI

InChI=1S/C8H14N2O3/c1-6-8(12)10(4-3-9-6)5-7(11)13-2/h6,9H,3-5H2,1-2H3/p+1/t6-/m1/s1