diethyl 2-[3-(2-azanylethyl)phenoxy]propanedioate; sulfuric acid

Systemtic Name: diethyl 2-[3-(2-azanylethyl)phenoxy]propanedioate; sulfuric acid Openeye Name: diethyl 2-[3-(2-aminoethyl)phenoxy]propanedioate; sulfuric acid CAS Name: 2-[3-(2-aminoethyl)phenoxy]propanedioic acid diethyl ester; sulfuric acid IUPAC Name: diethyl 2-[3-(2-aminoethyl)phenoxy]propanedioate; sulfuric acid Traditional Name: 2-[3-(2-aminoethyl)phenoxy]malonic acid diethyl ester; sulfuric acid Formula: C15H23NO9S MolecularWeight: 393.40942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)OC1=CC=CC(=C1)CCN.OS(=O)(=O)O

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)OC1=CC=CC(=C1)CCN.OS(=O)(=O)O

InChI

InChI=1S/C15H21NO5.H2O4S/c1-3-19-14(17)13(15(18)20-4-2)21-12-7-5-6-11(10-12)8-9-16;1-5(2,3)4/h5-7,10,13H,3-4,8-9,16H2,1-2H3;(H2,1,2,3,4)