6-bromanyl-3-(3,4-dimethoxyphenyl)chromen-2-one

Systemtic Name: 6-bromanyl-3-(3,4-dimethoxyphenyl)chromen-2-one Openeye Name: 6-bromo-3-(3,4-dimethoxyphenyl)chromen-2-one CAS Name: 6-bromo-3-(3,4-dimethoxyphenyl)-1-benzopyran-2-one IUPAC Name: 6-bromo-3-(3,4-dimethoxyphenyl)chromen-2-one Traditional Name: 6-bromo-3-(3,4-dimethoxyphenyl)coumarin Formula: C17H13BrO4 MolecularWeight: 361.18672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC3=C(C=CC(=C3)Br)OC2=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC3=C(C=CC(=C3)Br)OC2=O)OC

InChI

InChI=1S/C17H13BrO4/c1-20-15-5-3-10(9-16(15)21-2)13-8-11-7-12(18)4-6-14(11)22-17(13)19/h3-9H,1-2H3