(2S)-2-[2-[bis(prop-2-enyl)azaniumyl]ethanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[2-[bis(prop-2-enyl)azaniumyl]ethanoylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[[2-(diallylammonio)acetyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[2-[bis(prop-2-enyl)ammonio]-1-oxoethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[[2-[bis(prop-2-enyl)azaniumyl]acetyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[2-(diallylammonio)acetyl]amino]-4-(methylthio)butyrate Formula: C13H22N2O3S MolecularWeight: 286.39038

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])NC(=O)C[NH+](CC=C)CC=C

Isomeric SMILES

CSCC[C@@H](C(=O)[O-])NC(=O)C[NH+](CC=C)CC=C

InChI

InChI=1S/C13H22N2O3S/c1-4-7-15(8-5-2)10-12(16)14-11(13(17)18)6-9-19-3/h4-5,11H,1-2,6-10H2,3H3,(H,14,16)(H,17,18)/t11-/m0/s1