[2-(cyanomethyl)-2,3-bis(oxidanyl)propyl] ethanoate

Systemtic Name: [2-(cyanomethyl)-2,3-bis(oxidanyl)propyl] ethanoate Openeye Name: [2-(cyanomethyl)-2,3-dihydroxy-propyl] acetate CAS Name: acetic acid [2-(cyanomethyl)-2,3-dihydroxypropyl] ester IUPAC Name: [2-(cyanomethyl)-2,3-dihydroxypropyl] acetate Traditional Name: acetic acid [2-(cyanomethyl)-2,3-dihydroxy-propyl] ester Formula: C7H11NO4 MolecularWeight: 173.16654

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CC#N)(CO)O

Isomeric SMILES

CC(=O)OCC(CC#N)(CO)O

InChI

InChI=1S/C7H11NO4/c1-6(10)12-5-7(11,4-9)2-3-8/h9,11H,2,4-5H2,1H3