2-(2-phenoxyethanoylamino)propane-1,2,3-tricarboxylic acid

Systemtic Name: 2-(2-phenoxyethanoylamino)propane-1,2,3-tricarboxylic acid Openeye Name: 2-[(2-phenoxyacetyl)amino]propane-1,2,3-tricarboxylic acid CAS Name: 2-[(1-oxo-2-phenoxyethyl)amino]propane-1,2,3-tricarboxylic acid IUPAC Name: 2-[(2-phenoxyacetyl)amino]propane-1,2,3-tricarboxylic acid Traditional Name: 2-[(2-phenoxyacetyl)amino]propane-1,2,3-tricarboxylic acid Formula: C14H15NO8 MolecularWeight: 325.2708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(=O)NC(CC(=O)O)(CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OCC(=O)NC(CC(=O)O)(CC(=O)O)C(=O)O

InChI

InChI=1S/C14H15NO8/c16-10(8-23-9-4-2-1-3-5-9)15-14(13(21)22,6-11(17)18)7-12(19)20/h1-5H,6-8H2,(H,15,16)(H,17,18)(H,19,20)(H,21,22)