2-(1-azanylpropoxy)-2-oxidanylidene-ethanoate; dibenzofuran; hydrate

Systemtic Name: 2-(1-azanylpropoxy)-2-oxidanylidene-ethanoate; dibenzofuran; hydrate Openeye Name: 2-(1-aminopropoxy)-2-oxo-acetate; dibenzofuran; hydrate CAS Name: 2-(1-aminopropoxy)-2-oxoacetate; dibenzofuran; hydrate IUPAC Name: 2-(1-aminopropoxy)-2-oxoacetate; dibenzofuran; hydrate Traditional Name: 2-(1-aminopropoxy)-2-keto-acetate; dibenzofuran; hydrate Formula: C17H18NO6- MolecularWeight: 332.32792

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N)OC(=O)C(=O)[O-].C1=CC=C2C(=C1)C3=CC=CC=C3O2.O

Isomeric SMILES

CCC(N)OC(=O)C(=O)[O-].C1=CC=C2C(=C1)C3=CC=CC=C3O2.O

InChI

InChI=1S/C12H8O.C5H9NO4.H2O/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-2-3(6)10-5(9)4(7)8;/h1-8H;3H,2,6H2,1H3,(H,7,8);1H2/p-1