2-isocyanatopentanoate; 4-oxidanylidenepentanoate

Systemtic Name: 2-isocyanatopentanoate; 4-oxidanylidenepentanoate Openeye Name: 2-isocyanatopentanoate; 4-oxopentanoate CAS Name: 2-isocyanatopentanoate; 4-oxopentanoate IUPAC Name: 2-isocyanatopentanoate; 4-oxopentanoate Traditional Name: 2-isocyanatovalerate; 4-ketovalerate Formula: C11H15NO6-2 MolecularWeight: 257.2399

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)[O-])N=C=O.CC(=O)CCC(=O)[O-]

Isomeric SMILES

CCCC(C(=O)[O-])N=C=O.CC(=O)CCC(=O)[O-]

InChI

InChI=1S/C6H9NO3.C5H8O3/c1-2-3-5(6(9)10)7-4-8;1-4(6)2-3-5(7)8/h5H,2-3H2,1H3,(H,9,10);2-3H2,1H3,(H,7,8)/p-2