5-[(4-bromophenyl)methoxy]-4,7-dimethyl-3-(phenylmethyl)chromen-2-one

Systemtic Name: 5-[(4-bromophenyl)methoxy]-4,7-dimethyl-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-5-[(4-bromophenyl)methoxy]-4,7-dimethyl-chromen-2-one CAS Name: 5-[(4-bromophenyl)methoxy]-4,7-dimethyl-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-5-[(4-bromophenyl)methoxy]-4,7-dimethylchromen-2-one Traditional Name: 3-benzyl-5-(4-bromobenzyl)oxy-4,7-dimethyl-coumarin Formula: C25H21BrO3 MolecularWeight: 449.33644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OCC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OCC4=CC=C(C=C4)Br

InChI

InChI=1S/C25H21BrO3/c1-16-12-22(28-15-19-8-10-20(26)11-9-19)24-17(2)21(25(27)29-23(24)13-16)14-18-6-4-3-5-7-18/h3-13H,14-15H2,1-2H3