3-(2-bromanyl-4-methyl-phenoxy)chromen-2-one

Systemtic Name: 3-(2-bromanyl-4-methyl-phenoxy)chromen-2-one Openeye Name: 3-(2-bromo-4-methyl-phenoxy)chromen-2-one CAS Name: 3-(2-bromo-4-methylphenoxy)-1-benzopyran-2-one IUPAC Name: 3-(2-bromo-4-methylphenoxy)chromen-2-one Traditional Name: 3-(2-bromo-4-methyl-phenoxy)coumarin Formula: C16H11BrO3 MolecularWeight: 331.16074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2=CC3=CC=CC=C3OC2=O)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=CC3=CC=CC=C3OC2=O)Br

InChI

InChI=1S/C16H11BrO3/c1-10-6-7-14(12(17)8-10)19-15-9-11-4-2-3-5-13(11)20-16(15)18/h2-9H,1H3