(4S)-4-azanyl-5-[(2S,4R)-2-(carboxymethylcarbamoyl)-4-oxidanyl-pyrrolidin-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-4-azanyl-5-[(2S,4R)-2-(carboxymethylcarbamoyl)-4-oxidanyl-pyrrolidin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-4-amino-5-[(2S,4R)-2-(carboxymethylcarbamoyl)-4-hydroxy-pyrrolidin-1-yl]-5-oxo-pentanoic acid CAS Name: (4S)-4-amino-5-[(2S,4R)-2-[(carboxymethylamino)-oxomethyl]-4-hydroxy-1-pyrrolidinyl]-5-oxopentanoic acid IUPAC Name: (4S)-4-amino-5-[(2S,4R)-2-(carboxymethylcarbamoyl)-4-hydroxypyrrolidin-1-yl]-5-oxopentanoic acid Traditional Name: (4S)-4-amino-5-[(2S,4R)-2-(carboxymethylcarbamoyl)-4-hydroxy-pyrrolidino]-5-keto-valeric acid Formula: C12H19N3O7 MolecularWeight: 317.29516

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)NCC(=O)O)C(=O)C(CCC(=O)O)N)O

Isomeric SMILES

C1[C@H](CN([C@@H]1C(=O)NCC(=O)O)C(=O)[C@H](CCC(=O)O)N)O

InChI

InChI=1S/C12H19N3O7/c13-7(1-2-9(17)18)12(22)15-5-6(16)3-8(15)11(21)14-4-10(19)20/h6-8,16H,1-5,13H2,(H,14,21)(H,17,18)(H,19,20)/t6-,7+,8+/m1/s1