(4S)-4-(5-bromanyl-2-methoxy-phenyl)-7-oxidanyl-3,4-dihydrochromen-2-one

Systemtic Name: (4S)-4-(5-bromanyl-2-methoxy-phenyl)-7-oxidanyl-3,4-dihydrochromen-2-one Openeye Name: (4S)-4-(5-bromo-2-methoxy-phenyl)-7-hydroxy-chroman-2-one CAS Name: (4S)-4-(5-bromo-2-methoxyphenyl)-7-hydroxy-3,4-dihydro-2H-1-benzopyran-2-one IUPAC Name: (4S)-4-(5-bromo-2-methoxyphenyl)-7-hydroxy-3,4-dihydrochromen-2-one Traditional Name: (4S)-4-(5-bromo-2-methoxy-phenyl)-7-hydroxy-chroman-2-one Formula: C16H13BrO4 MolecularWeight: 349.17602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

COC1=C(C=C(C=C1)Br)[C@H]2CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C16H13BrO4/c1-20-14-5-2-9(17)6-13(14)12-8-16(19)21-15-7-10(18)3-4-11(12)15/h2-7,12,18H,8H2,1H3/t12-/m0/s1