7-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-4,8-dimethyl-3-(phenylmethyl)chromen-2-one

Systemtic Name: 7-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-4,8-dimethyl-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-7-[(2-chloro-6-fluoro-phenyl)methoxy]-4,8-dimethyl-chromen-2-one CAS Name: 7-[(2-chloro-6-fluorophenyl)methoxy]-4,8-dimethyl-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-7-[(2-chloro-6-fluorophenyl)methoxy]-4,8-dimethylchromen-2-one Traditional Name: 3-benzyl-7-(2-chloro-6-fluoro-benzyl)oxy-4,8-dimethyl-coumarin Formula: C25H20ClFO3 MolecularWeight: 422.875903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC3=C(C=CC=C3Cl)F)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC3=C(C=CC=C3Cl)F)CC4=CC=CC=C4

InChI

InChI=1S/C25H20ClFO3/c1-15-18-11-12-23(29-14-20-21(26)9-6-10-22(20)27)16(2)24(18)30-25(28)19(15)13-17-7-4-3-5-8-17/h3-12H,13-14H2,1-2H3