1,1,1-tris(hydroxymethylamino)-3-methyl-but-3-en-2-one

Systemtic Name: 1,1,1-tris(hydroxymethylamino)-3-methyl-but-3-en-2-one Openeye Name: 1,1,1-tris(hydroxymethylamino)-3-methyl-but-3-en-2-one CAS Name: 1,1,1-tris(hydroxymethylamino)-3-methyl-3-buten-2-one IUPAC Name: 1,1,1-tris(hydroxymethylamino)-3-methylbut-3-en-2-one Traditional Name: 3-methyl-1,1,1-tris(methylolamino)but-3-en-2-one Formula: C8H17N3O4 MolecularWeight: 219.23828

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)C(NCO)(NCO)NCO

Isomeric SMILES

CC(=C)C(=O)C(NCO)(NCO)NCO

InChI

InChI=1S/C8H17N3O4/c1-6(2)7(15)8(9-3-12,10-4-13)11-5-14/h9-14H,1,3-5H2,2H3