2-[[2,6-bis(oxidanyl)-3-(2-phenoxyethanoyl)phenyl]methylamino]propanoic acid

Systemtic Name: 2-[[2,6-bis(oxidanyl)-3-(2-phenoxyethanoyl)phenyl]methylamino]propanoic acid Openeye Name: 2-[[2,6-dihydroxy-3-(2-phenoxyacetyl)phenyl]methylamino]propanoic acid CAS Name: 2-[[2,6-dihydroxy-3-(1-oxo-2-phenoxyethyl)phenyl]methylamino]propanoic acid IUPAC Name: 2-[[2,6-dihydroxy-3-(2-phenoxyacetyl)phenyl]methylamino]propanoic acid Traditional Name: 2-[[2,6-dihydroxy-3-(2-phenoxyacetyl)benzyl]amino]propionic acid Formula: C18H19NO6 MolecularWeight: 345.34656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NCC1=C(C=CC(=C1O)C(=O)COC2=CC=CC=C2)O

Isomeric SMILES

CC(C(=O)O)NCC1=C(C=CC(=C1O)C(=O)COC2=CC=CC=C2)O

InChI

InChI=1S/C18H19NO6/c1-11(18(23)24)19-9-14-15(20)8-7-13(17(14)22)16(21)10-25-12-5-3-2-4-6-12/h2-8,11,19-20,22H,9-10H2,1H3,(H,23,24)