(2S)-2-[2-(2-chloranylethanoylamino)ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[2-(2-chloranylethanoylamino)ethanoylamino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[[2-[(2-chloroacetyl)amino]acetyl]amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[2-[(2-chloro-1-oxoethyl)amino]-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[[2-[(2-chloroacetyl)amino]acetyl]amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[[2-[(2-chloroacetyl)amino]acetyl]amino]-3-methyl-butyric acid Formula: C9H15ClN2O4 MolecularWeight: 250.6794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CNC(=O)CCl

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)CNC(=O)CCl

InChI

InChI=1S/C9H15ClN2O4/c1-5(2)8(9(15)16)12-7(14)4-11-6(13)3-10/h5,8H,3-4H2,1-2H3,(H,11,13)(H,12,14)(H,15,16)/t8-/m0/s1