sodium (Z)-ethoxy-(3-methyl-5-oxidanylidene-1,2-oxazol-4-ylidene)methanolate hydrate

Systemtic Name: sodium (Z)-ethoxy-(3-methyl-5-oxidanylidene-1,2-oxazol-4-ylidene)methanolate hydrate Openeye Name: sodium (Z)-ethoxy-(3-methyl-5-oxo-isoxazol-4-ylidene)methanolate hydrate CAS Name: sodium (Z)-ethoxy-(3-methyl-5-oxo-4-isoxazolylidene)methanolate hydrate IUPAC Name: sodium (Z)-ethoxy-(3-methyl-5-oxo-1,2-oxazol-4-ylidene)methanolate hydrate Traditional Name: sodium (Z)-ethoxy-(5-keto-3-methyl-2-isoxazolin-4-ylidene)methanolate hydrate Formula: C7H10NNaO5 MolecularWeight: 211.14777

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C1C(=NOC1=O)C)[O-].O.[Na+]

Isomeric SMILES

CCO/C(=C\1/C(=NOC1=O)C)/[O-].O.[Na+]

InChI

InChI=1S/C7H9NO4.Na.H2O/c1-3-11-6(9)5-4(2)8-12-7(5)10;;/h9H,3H2,1-2H3;;1H2/q;+1;/p-1/b6-5-;;