2-azanyl-5-[[1-(carboxymethylamino)-3-ethenylsulfonyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-azanyl-5-[[1-(carboxymethylamino)-3-ethenylsulfonyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 2-amino-5-[[2-(carboxymethylamino)-2-oxo-1-(vinylsulfonylmethyl)ethyl]amino]-5-oxo-pentanoic acid CAS Name: 2-amino-5-[[1-(carboxymethylamino)-3-ethenylsulfonyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 2-amino-5-[[1-(carboxymethylamino)-3-ethenylsulfonyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 2-amino-5-[[2-(carboxymethylamino)-2-keto-1-(vinylsulfonylmethyl)ethyl]amino]-5-keto-valeric acid Formula: C12H19N3O8S MolecularWeight: 365.35956

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Descriptors Computed from Structure

Canonical SMILES:

C=CS(=O)(=O)CC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N

Isomeric SMILES

C=CS(=O)(=O)CC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N

InChI

InChI=1S/C12H19N3O8S/c1-2-24(22,23)6-8(11(19)14-5-10(17)18)15-9(16)4-3-7(13)12(20)21/h2,7-8H,1,3-6,13H2,(H,14,19)(H,15,16)(H,17,18)(H,20,21)