2-phenoxy-2-[3-(2-phenoxyethylamino)propyl]propanedioic acid

Systemtic Name: 2-phenoxy-2-[3-(2-phenoxyethylamino)propyl]propanedioic acid Openeye Name: 2-phenoxy-2-[3-(2-phenoxyethylamino)propyl]propanedioic acid CAS Name: 2-phenoxy-2-[3-(2-phenoxyethylamino)propyl]propanedioic acid IUPAC Name: 2-phenoxy-2-[3-(2-phenoxyethylamino)propyl]propanedioic acid Traditional Name: 2-phenoxy-2-[3-(2-phenoxyethylamino)propyl]malonic acid Formula: C20H23NO6 MolecularWeight: 373.39972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCNCCCC(C(=O)O)(C(=O)O)OC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)OCCNCCCC(C(=O)O)(C(=O)O)OC2=CC=CC=C2

InChI

InChI=1S/C20H23NO6/c22-18(23)20(19(24)25,27-17-10-5-2-6-11-17)12-7-13-21-14-15-26-16-8-3-1-4-9-16/h1-6,8-11,21H,7,12-15H2,(H,22,23)(H,24,25)