2-azanyl-2-(hydroxymethyl)propane-1,3-diol; ethanenitrile

Systemtic Name: 2-azanyl-2-(hydroxymethyl)propane-1,3-diol; ethanenitrile Openeye Name: acetonitrile; 2-amino-2-(hydroxymethyl)propane-1,3-diol CAS Name: acetonitrile; 2-amino-2-(hydroxymethyl)propane-1,3-diol IUPAC Name: acetonitrile; 2-amino-2-(hydroxymethyl)propane-1,3-diol Traditional Name: acetonitrile; 2-amino-2-methylol-propane-1,3-diol Formula: C6H14N2O3 MolecularWeight: 162.18696

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.C(C(CO)(CO)N)O

Isomeric SMILES

CC#N.C(C(CO)(CO)N)O

InChI

InChI=1S/C4H11NO3.C2H3N/c5-4(1-6,2-7)3-8;1-2-3/h6-8H,1-3,5H2;1H3