methyl 3,3,3-tris(fluoranyl)-2-[3-methoxy-4-(phenoxycarbonylamino)phenyl]-2-oxidanyl-propanoate

Systemtic Name: methyl 3,3,3-tris(fluoranyl)-2-[3-methoxy-4-(phenoxycarbonylamino)phenyl]-2-oxidanyl-propanoate Openeye Name: methyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(phenoxycarbonylamino)phenyl]propanoate CAS Name: 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-[[oxo(phenoxy)methyl]amino]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3,3,3-trifluoro-2-hydroxy-2-[3-methoxy-4-(phenoxycarbonylamino)phenyl]propanoate Traditional Name: 2-[4-(carbophenoxyamino)-3-methoxy-phenyl]-3,3,3-trifluoro-2-hydroxy-propionic acid methyl ester Formula: C18H16F3NO6 MolecularWeight: 399.31795

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C(=O)OC)(C(F)(F)F)O)NC(=O)OC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=CC(=C1)C(C(=O)OC)(C(F)(F)F)O)NC(=O)OC2=CC=CC=C2

InChI

InChI=1S/C18H16F3NO6/c1-26-14-10-11(17(25,15(23)27-2)18(19,20)21)8-9-13(14)22-16(24)28-12-6-4-3-5-7-12/h3-10,25H,1-2H3,(H,22,24)