6-(2-bromoethyloxy)-7-methoxy-4-methyl-chromen-2-one

Systemtic Name: 6-(2-bromoethyloxy)-7-methoxy-4-methyl-chromen-2-one Openeye Name: 6-(2-bromoethoxy)-7-methoxy-4-methyl-chromen-2-one CAS Name: 6-(2-bromoethoxy)-7-methoxy-4-methyl-1-benzopyran-2-one IUPAC Name: 6-(2-bromoethoxy)-7-methoxy-4-methylchromen-2-one Traditional Name: 6-(2-bromoethoxy)-7-methoxy-4-methyl-coumarin Formula: C13H13BrO4 MolecularWeight: 313.14392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)OCCBr)OC

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)OCCBr)OC

InChI

InChI=1S/C13H13BrO4/c1-8-5-13(15)18-10-7-11(16-2)12(6-9(8)10)17-4-3-14/h5-7H,3-4H2,1-2H3