[4-oxidanylidene-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 2-azanyl-3-(4-hydroxyphenyl)propanoate

Systemtic Name: [4-oxidanylidene-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 2-azanyl-3-(4-hydroxyphenyl)propanoate Openeye Name: [4-oxo-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 2-amino-3-(4-hydroxyphenyl)propanoate CAS Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid [4-oxo-3-phenoxy-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [4-oxo-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 2-amino-3-(4-hydroxyphenyl)propanoate Traditional Name: 2-amino-3-(4-hydroxyphenyl)propionic acid [4-keto-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] ester Formula: C25H18F3NO6 MolecularWeight: 485.40873

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C(CC4=CC=C(C=C4)O)N)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C(CC4=CC=C(C=C4)O)N)C(F)(F)F

InChI

InChI=1S/C25H18F3NO6/c26-25(27,28)23-22(33-16-4-2-1-3-5-16)21(31)18-11-10-17(13-20(18)35-23)34-24(32)19(29)12-14-6-8-15(30)9-7-14/h1-11,13,19,30H,12,29H2