2-[[4-methoxy-4-oxidanylidene-2-(sulfanylmethyl)butanoyl]amino]butanedioic acid

Systemtic Name: 2-[[4-methoxy-4-oxidanylidene-2-(sulfanylmethyl)butanoyl]amino]butanedioic acid Openeye Name: 2-[[4-methoxy-4-oxo-2-(sulfanylmethyl)butanoyl]amino]butanedioic acid CAS Name: 2-[[2-(mercaptomethyl)-4-methoxy-1,4-dioxobutyl]amino]butanedioic acid IUPAC Name: 2-[[4-methoxy-4-oxo-2-(sulfanylmethyl)butanoyl]amino]butanedioic acid Traditional Name: 2-[[4-keto-2-(mercaptomethyl)-4-methoxy-butanoyl]amino]succinic acid Formula: C10H15NO7S MolecularWeight: 293.2936

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CS)C(=O)NC(CC(=O)O)C(=O)O

Isomeric SMILES

COC(=O)CC(CS)C(=O)NC(CC(=O)O)C(=O)O

InChI

InChI=1S/C10H15NO7S/c1-18-8(14)2-5(4-19)9(15)11-6(10(16)17)3-7(12)13/h5-6,19H,2-4H2,1H3,(H,11,15)(H,12,13)(H,16,17)