5-acetamido-4-azanyl-6-[2,3-bis(oxidanyl)propoxy]-2-methylidene-heptanoic acid

Systemtic Name: 5-acetamido-4-azanyl-6-[2,3-bis(oxidanyl)propoxy]-2-methylidene-heptanoic acid Openeye Name: 5-acetamido-4-amino-6-(2,3-dihydroxypropoxy)-2-methylene-heptanoic acid CAS Name: 5-acetamido-4-amino-6-(2,3-dihydroxypropoxy)-2-methyleneheptanoic acid IUPAC Name: 5-acetamido-4-amino-6-(2,3-dihydroxypropoxy)-2-methylideneheptanoic acid Traditional Name: 2-(3-acetamido-2-amino-4-glyceryloxy-pentyl)acrylic acid Formula: C13H24N2O6 MolecularWeight: 304.33946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(CC(=C)C(=O)O)N)NC(=O)C)OCC(CO)O

Isomeric SMILES

CC(C(C(CC(=C)C(=O)O)N)NC(=O)C)OCC(CO)O

InChI

InChI=1S/C13H24N2O6/c1-7(13(19)20)4-11(14)12(15-9(3)17)8(2)21-6-10(18)5-16/h8,10-12,16,18H,1,4-6,14H2,2-3H3,(H,15,17)(H,19,20)