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

Systemtic Name: 2-[(5-azanyl-2-ethyl-4-methyl-5-oxidanylidene-pentanoyl)amino]-2-methyl-propane-1-sulfonic acid Openeye Name: 2-[(5-amino-2-ethyl-4-methyl-5-oxo-pentanoyl)amino]-2-methyl-propane-1-sulfonic acid CAS Name: 2-[(5-amino-2-ethyl-4-methyl-1,5-dioxopentyl)amino]-2-methyl-1-propanesulfonic acid IUPAC Name: 2-[(5-amino-2-ethyl-4-methyl-5-oxopentanoyl)amino]-2-methylpropane-1-sulfonic acid Traditional Name: 2-[(5-amino-2-ethyl-5-keto-4-methyl-pentanoyl)amino]-2-methyl-propane-1-sulfonic acid Formula: C12H24N2O5S MolecularWeight: 308.39436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H24N2O5S/c1-5-9(6-8(2)10(13)15)11(16)14-12(3,4)7-20(17,18)19/h8-9H,5-7H2,1-4H3,(H2,13,15)(H,14,16)(H,17,18,19)