5-[[1-(decylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]carbamoyl]-2-oxidanylidene-1,3,2-dioxathiolane-4-carboxylic acid

Systemtic Name: 5-[[1-(decylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]carbamoyl]-2-oxidanylidene-1,3,2-dioxathiolane-4-carboxylic acid Openeye Name: 5-[[1-(decylcarbamoyl)-3-methyl-butyl]carbamoyl]-2-oxo-1,3,2-dioxathiolane-4-carboxylic acid CAS Name: 5-[[[1-(decylamino)-4-methyl-1-oxopentan-2-yl]amino]-oxomethyl]-2-oxo-1,3,2-dioxathiolane-4-carboxylic acid IUPAC Name: 5-[[1-(decylamino)-4-methyl-1-oxopentan-2-yl]carbamoyl]-2-oxo-1,3,2-dioxathiolane-4-carboxylic acid Traditional Name: 5-[[1-(decylcarbamoyl)-3-methyl-butyl]carbamoyl]-2-keto-1,3,2-dioxathiolane-4-carboxylic acid Formula: C20H36N2O7S MolecularWeight: 448.57404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNC(=O)C(CC(C)C)NC(=O)C1C(OS(=O)O1)C(=O)O

Isomeric SMILES

CCCCCCCCCCNC(=O)C(CC(C)C)NC(=O)C1C(OS(=O)O1)C(=O)O

InChI

InChI=1S/C20H36N2O7S/c1-4-5-6-7-8-9-10-11-12-21-18(23)15(13-14(2)3)22-19(24)16-17(20(25)26)29-30(27)28-16/h14-17H,4-13H2,1-3H3,(H,21,23)(H,22,24)(H,25,26)