2-[3-(4-hydroxyphenyl)propanoylamino]pentanedioic acid

Systemtic Name: 2-[3-(4-hydroxyphenyl)propanoylamino]pentanedioic acid Openeye Name: 2-[3-(4-hydroxyphenyl)propanoylamino]pentanedioic acid CAS Name: 2-[[3-(4-hydroxyphenyl)-1-oxopropyl]amino]pentanedioic acid IUPAC Name: 2-[3-(4-hydroxyphenyl)propanoylamino]pentanedioic acid Traditional Name: 2-[3-(4-hydroxyphenyl)propanoylamino]glutaric acid Formula: C14H17NO6 MolecularWeight: 295.28788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)NC(CCC(=O)O)C(=O)O)O

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)NC(CCC(=O)O)C(=O)O)O

InChI

InChI=1S/C14H17NO6/c16-10-4-1-9(2-5-10)3-7-12(17)15-11(14(20)21)6-8-13(18)19/h1-2,4-5,11,16H,3,6-8H2,(H,15,17)(H,18,19)(H,20,21)