(3S,4R)-6-bromanyl-3-ethanoyl-4-[(2R)-1-oxidanylidene-1-phenyl-propan-2-yl]-3,4-dihydrochromen-2-one

Systemtic Name: (3S,4R)-6-bromanyl-3-ethanoyl-4-[(2R)-1-oxidanylidene-1-phenyl-propan-2-yl]-3,4-dihydrochromen-2-one Openeye Name: (3S,4R)-3-acetyl-6-bromo-4-[(1R)-1-methyl-2-oxo-2-phenyl-ethyl]chroman-2-one CAS Name: (3S,4R)-3-acetyl-6-bromo-4-[(2R)-1-oxo-1-phenylpropan-2-yl]-3,4-dihydro-2H-1-benzopyran-2-one IUPAC Name: (3S,4R)-3-acetyl-6-bromo-4-[(2R)-1-oxo-1-phenylpropan-2-yl]-3,4-dihydrochromen-2-one Traditional Name: (3S,4R)-3-acetyl-6-bromo-4-[(1R)-2-keto-1-methyl-2-phenyl-ethyl]chroman-2-one Formula: C20H17BrO4 MolecularWeight: 401.25058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(C(=O)OC2=C1C=C(C=C2)Br)C(=O)C)C(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@H]([C@@H]1[C@H](C(=O)OC2=C1C=C(C=C2)Br)C(=O)C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H17BrO4/c1-11(19(23)13-6-4-3-5-7-13)17-15-10-14(21)8-9-16(15)25-20(24)18(17)12(2)22/h3-11,17-18H,1-2H3/t11-,17+,18-/m1/s1