2-[(5-ethoxy-2-ethyl-4-methyl-5-oxidanylidene-pentanoyl)amino]-2-methyl-propane-1-sulfonic acid

Systemtic Name: 2-[(5-ethoxy-2-ethyl-4-methyl-5-oxidanylidene-pentanoyl)amino]-2-methyl-propane-1-sulfonic acid Openeye Name: 2-[(5-ethoxy-2-ethyl-4-methyl-5-oxo-pentanoyl)amino]-2-methyl-propane-1-sulfonic acid CAS Name: 2-[(5-ethoxy-2-ethyl-4-methyl-1,5-dioxopentyl)amino]-2-methyl-1-propanesulfonic acid IUPAC Name: 2-[(5-ethoxy-2-ethyl-4-methyl-5-oxopentanoyl)amino]-2-methylpropane-1-sulfonic acid Traditional Name: 2-[(5-ethoxy-2-ethyl-5-keto-4-methyl-pentanoyl)amino]-2-methyl-propane-1-sulfonic acid Formula: C14H27NO6S MolecularWeight: 337.43228

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)C(=O)OCC)C(=O)NC(C)(C)CS(=O)(=O)O

Isomeric SMILES

CCC(CC(C)C(=O)OCC)C(=O)NC(C)(C)CS(=O)(=O)O

InChI

InChI=1S/C14H27NO6S/c1-6-11(8-10(3)13(17)21-7-2)12(16)15-14(4,5)9-22(18,19)20/h10-11H,6-9H2,1-5H3,(H,15,16)(H,18,19,20)