trilithium (2S)-2-[[(3S)-3-acetamido-4-oxidanidyl-4-oxidanylidene-butanoyl]amino]-6-oxidanylidene-heptanedioate

Systemtic Name: trilithium (2S)-2-[[(3S)-3-acetamido-4-oxidanidyl-4-oxidanylidene-butanoyl]amino]-6-oxidanylidene-heptanedioate Openeye Name: trilithium (2S)-2-[[(3S)-3-acetamido-4-oxido-4-oxo-butanoyl]amino]-6-oxo-heptanedioate CAS Name: trilithium (2S)-2-[[(3S)-3-acetamido-4-oxido-1,4-dioxobutyl]amino]-6-oxoheptanedioate IUPAC Name: trilithium (2S)-2-[[(3S)-3-acetamido-4-oxido-4-oxobutanoyl]amino]-6-oxoheptanedioate Traditional Name: trilithium (2S)-2-[[(3S)-3-acetamido-4-keto-4-oxido-butanoyl]amino]-6-keto-pimelate Formula: C13H15Li3N2O9 MolecularWeight: 364.0892

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].[Li+].[Li+].CC(=O)NC(CC(=O)NC(CCCC(=O)C(=O)[O-])C(=O)[O-])C(=O)[O-]

Isomeric SMILES

[Li+].[Li+].[Li+].CC(=O)N[C@@H](CC(=O)N[C@@H](CCCC(=O)C(=O)[O-])C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C13H18N2O9.3Li/c1-6(16)14-8(12(21)22)5-10(18)15-7(11(19)20)3-2-4-9(17)13(23)24;;;/h7-8H,2-5H2,1H3,(H,14,16)(H,15,18)(H,19,20)(H,21,22)(H,23,24);;;/q;3*+1/p-3/t7-,8-;;;/m0.../s1