(2S)-2-[2-[bis(prop-2-enyl)azaniumyl]ethanoylamino]-3-methyl-butanoate

Systemtic Name: (2S)-2-[2-[bis(prop-2-enyl)azaniumyl]ethanoylamino]-3-methyl-butanoate Openeye Name: (2S)-2-[[2-(diallylammonio)acetyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[2-[bis(prop-2-enyl)ammonio]-1-oxoethyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[[2-[bis(prop-2-enyl)azaniumyl]acetyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[2-(diallylammonio)acetyl]amino]-3-methyl-butyrate Formula: C13H22N2O3 MolecularWeight: 254.32538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22N2O3/c1-5-7-15(8-6-2)9-11(16)14-12(10(3)4)13(17)18/h5-6,10,12H,1-2,7-9H2,3-4H3,(H,14,16)(H,17,18)/t12-/m0/s1