butane; 4-isocyanatooxy-4-oxidanylidene-butanoate

Systemtic Name: butane; 4-isocyanatooxy-4-oxidanylidene-butanoate Openeye Name: butane; 4-isocyanatooxy-4-oxo-butanoate CAS Name: butane; 4-isocyanatooxy-4-oxobutanoate IUPAC Name: butane; 4-isocyanatooxy-4-oxobutanoate Traditional Name: 4-isocyanatooxy-4-keto-butyrate; n-butane Formula: C9H14NO5- MolecularWeight: 216.21116

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Descriptors Computed from Structure

Canonical SMILES:

CCCC.C(CC(=O)ON=C=O)C(=O)[O-]

Isomeric SMILES

CCCC.C(CC(=O)ON=C=O)C(=O)[O-]

InChI

InChI=1S/C5H5NO5.C4H10/c7-3-6-11-5(10)2-1-4(8)9;1-3-4-2/h1-2H2,(H,8,9);3-4H2,1-2H3/p-1