ethyl (2S)-3-methyl-2-piperazin-4-ium-1-yl-butanoate

Systemtic Name: ethyl (2S)-3-methyl-2-piperazin-4-ium-1-yl-butanoate Openeye Name: ethyl (2S)-3-methyl-2-piperazin-4-ium-1-yl-butanoate CAS Name: (2S)-3-methyl-2-(1-piperazin-4-iumyl)butanoic acid ethyl ester IUPAC Name: ethyl (2S)-3-methyl-2-piperazin-4-ium-1-ylbutanoate Traditional Name: (2S)-3-methyl-2-piperazin-4-ium-1-yl-butyric acid ethyl ester Formula: C11H23N2O2+ MolecularWeight: 215.31252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C)N1CC[NH2+]CC1

Isomeric SMILES

CCOC(=O)[C@H](C(C)C)N1CC[NH2+]CC1

InChI

InChI=1S/C11H22N2O2/c1-4-15-11(14)10(9(2)3)13-7-5-12-6-8-13/h9-10,12H,4-8H2,1-3H3/p+1/t10-/m0/s1