5-isocyano-4-oxidanyl-pentan-2-one

Systemtic Name: 5-isocyano-4-oxidanyl-pentan-2-one Openeye Name: 4-hydroxy-5-isocyano-pentan-2-one CAS Name: 4-hydroxy-5-isocyano-2-pentanone IUPAC Name: 4-hydroxy-5-isocyanopentan-2-one Traditional Name: 4-hydroxy-5-isocyano-pentan-2-one Formula: C6H9NO2 MolecularWeight: 127.14116

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C[N+]#[C-])O

Isomeric SMILES

CC(=O)CC(C[N+]#[C-])O

InChI

InChI=1S/C6H9NO2/c1-5(8)3-6(9)4-7-2/h6,9H,3-4H2,1H3