[5-acetamido-2-azanyl-4,6,7-tris(oxidanyl)octan-3-yl] prop-2-enoate

Systemtic Name: [5-acetamido-2-azanyl-4,6,7-tris(oxidanyl)octan-3-yl] prop-2-enoate Openeye Name: [3-acetamido-1-(1-aminoethyl)-2,4,5-trihydroxy-hexyl] prop-2-enoate CAS Name: 2-propenoic acid (5-acetamido-2-amino-4,6,7-trihydroxyoctan-3-yl) ester IUPAC Name: (5-acetamido-2-amino-4,6,7-trihydroxyoctan-3-yl) prop-2-enoate Traditional Name: acrylic acid [3-acetamido-1-(1-aminoethyl)-2,4,5-trihydroxy-hexyl] ester Formula: C13H24N2O6 MolecularWeight: 304.33946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(C(C(C(C)O)O)NC(=O)C)O)OC(=O)C=C)N

Isomeric SMILES

CC(C(C(C(C(C(C)O)O)NC(=O)C)O)OC(=O)C=C)N

InChI

InChI=1S/C13H24N2O6/c1-5-9(18)21-13(6(2)14)12(20)10(15-8(4)17)11(19)7(3)16/h5-7,10-13,16,19-20H,1,14H2,2-4H3,(H,15,17)