(2S,3S)-2-(1,3-benzodioxol-5-yl)-6-bromanyl-3-oxidanyl-2,3-dihydrochromen-4-one

Systemtic Name: (2S,3S)-2-(1,3-benzodioxol-5-yl)-6-bromanyl-3-oxidanyl-2,3-dihydrochromen-4-one Openeye Name: (2S,3S)-2-(1,3-benzodioxol-5-yl)-6-bromo-3-hydroxy-chroman-4-one CAS Name: (2S,3S)-2-(1,3-benzodioxol-5-yl)-6-bromo-3-hydroxy-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: (2S,3S)-2-(1,3-benzodioxol-5-yl)-6-bromo-3-hydroxy-2,3-dihydrochromen-4-one Traditional Name: (2S,3S)-2-(1,3-benzodioxol-5-yl)-6-bromo-3-hydroxy-chroman-4-one Formula: C16H11BrO5 MolecularWeight: 363.15954

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3C(C(=O)C4=C(O3)C=CC(=C4)Br)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)[C@H]3[C@@H](C(=O)C4=C(O3)C=CC(=C4)Br)O

InChI

InChI=1S/C16H11BrO5/c17-9-2-4-11-10(6-9)14(18)15(19)16(22-11)8-1-3-12-13(5-8)21-7-20-12/h1-6,15-16,19H,7H2/t15-,16+/m1/s1