(2S)-2-[[(2S)-2-(2-azaniumylethanoylamino)propanoyl]amino]-4-methyl-pentanoate

Systemtic Name: (2S)-2-[[(2S)-2-(2-azaniumylethanoylamino)propanoyl]amino]-4-methyl-pentanoate Openeye Name: (2S)-2-[[(2S)-2-[(2-azaniumylacetyl)amino]propanoyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(2S)-2-[(2-ammonio-1-oxoethyl)amino]-1-oxopropyl]amino]-4-methylpentanoate IUPAC Name: (2S)-2-[[(2S)-2-[(2-azaniumylacetyl)amino]propanoyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[(2S)-2-[(2-ammonioacetyl)amino]propanoyl]amino]-4-methyl-valerate Formula: C11H21N3O4 MolecularWeight: 259.30214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)C(C)NC(=O)C[NH3+]

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)[O-])NC(=O)C[NH3+]

InChI

InChI=1S/C11H21N3O4/c1-6(2)4-8(11(17)18)14-10(16)7(3)13-9(15)5-12/h6-8H,4-5,12H2,1-3H3,(H,13,15)(H,14,16)(H,17,18)/t7-,8-/m0/s1