4-phenyl-7-[[2,3,6-tris(chloranyl)phenyl]methoxy]chromen-2-one

Systemtic Name: 4-phenyl-7-[[2,3,6-tris(chloranyl)phenyl]methoxy]chromen-2-one Openeye Name: 4-phenyl-7-[(2,3,6-trichlorophenyl)methoxy]chromen-2-one CAS Name: 4-phenyl-7-[(2,3,6-trichlorophenyl)methoxy]-1-benzopyran-2-one IUPAC Name: 4-phenyl-7-[(2,3,6-trichlorophenyl)methoxy]chromen-2-one Traditional Name: 4-phenyl-7-(2,3,6-trichlorobenzyl)oxy-coumarin Formula: C22H13Cl3O3 MolecularWeight: 431.69582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)OC3=C2C=CC(=C3)OCC4=C(C=CC(=C4Cl)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)OC3=C2C=CC(=C3)OCC4=C(C=CC(=C4Cl)Cl)Cl

InChI

InChI=1S/C22H13Cl3O3/c23-18-8-9-19(24)22(25)17(18)12-27-14-6-7-15-16(13-4-2-1-3-5-13)11-21(26)28-20(15)10-14/h1-11H,12H2