methyl 2,5-diisocyanopentanoate

Systemtic Name: methyl 2,5-diisocyanopentanoate Openeye Name: methyl 2,5-diisocyanopentanoate CAS Name: 2,5-diisocyanopentanoic acid methyl ester IUPAC Name: methyl 2,5-diisocyanopentanoate Traditional Name: 2,5-diisocyanovaleric acid methyl ester Formula: C8H10N2O2 MolecularWeight: 166.1772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC[N+]#[C-])[N+]#[C-]

Isomeric SMILES

COC(=O)C(CCC[N+]#[C-])[N+]#[C-]

InChI

InChI=1S/C8H10N2O2/c1-9-6-4-5-7(10-2)8(11)12-3/h7H,4-6H2,3H3