diethyl 2-[[3-[4-(3-methoxy-3-oxidanylidene-propyl)phenoxy]-2-oxidanyl-propyl]amino]propanedioate

Systemtic Name: diethyl 2-[[3-[4-(3-methoxy-3-oxidanylidene-propyl)phenoxy]-2-oxidanyl-propyl]amino]propanedioate Openeye Name: diethyl 2-[[2-hydroxy-3-[4-(3-methoxy-3-oxo-propyl)phenoxy]propyl]amino]propanedioate CAS Name: 2-[[2-hydroxy-3-[4-(3-methoxy-3-oxopropyl)phenoxy]propyl]amino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[2-hydroxy-3-[4-(3-methoxy-3-oxopropyl)phenoxy]propyl]amino]propanedioate Traditional Name: 2-[[2-hydroxy-3-[4-(3-keto-3-methoxy-propyl)phenoxy]propyl]amino]malonic acid diethyl ester Formula: C20H29NO8 MolecularWeight: 411.44616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)NCC(COC1=CC=C(C=C1)CCC(=O)OC)O

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)NCC(COC1=CC=C(C=C1)CCC(=O)OC)O

InChI

InChI=1S/C20H29NO8/c1-4-27-19(24)18(20(25)28-5-2)21-12-15(22)13-29-16-9-6-14(7-10-16)8-11-17(23)26-3/h6-7,9-10,15,18,21-22H,4-5,8,11-13H2,1-3H3