(2R)-2-[[(2S)-2-ethylhexanoyl]amino]-4-methylsulfonyl-butanoate

Systemtic Name: (2R)-2-[[(2S)-2-ethylhexanoyl]amino]-4-methylsulfonyl-butanoate Openeye Name: (2R)-2-[[(2S)-2-ethylhexanoyl]amino]-4-methylsulfonyl-butanoate CAS Name: (2R)-2-[[(2S)-2-ethyl-1-oxohexyl]amino]-4-methylsulfonylbutanoate IUPAC Name: (2R)-2-[[(2S)-2-ethylhexanoyl]amino]-4-methylsulfonylbutanoate Traditional Name: (2R)-2-[[(2S)-2-ethylhexanoyl]amino]-4-mesyl-butyrate Formula: C13H24NO5S- MolecularWeight: 306.39836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC(CCS(=O)(=O)C)C(=O)[O-]

Isomeric SMILES

CCCC[C@H](CC)C(=O)N[C@H](CCS(=O)(=O)C)C(=O)[O-]

InChI

InChI=1S/C13H25NO5S/c1-4-6-7-10(5-2)12(15)14-11(13(16)17)8-9-20(3,18)19/h10-11H,4-9H2,1-3H3,(H,14,15)(H,16,17)/p-1/t10-,11+/m0/s1