6-bromanyl-4-(5,5-dimethyl-4-phenyl-1,3-dioxan-2-yl)-7-oxidanyl-chromen-2-one

Systemtic Name: 6-bromanyl-4-(5,5-dimethyl-4-phenyl-1,3-dioxan-2-yl)-7-oxidanyl-chromen-2-one Openeye Name: 6-bromo-4-(5,5-dimethyl-4-phenyl-1,3-dioxan-2-yl)-7-hydroxy-chromen-2-one CAS Name: 6-bromo-4-(5,5-dimethyl-4-phenyl-1,3-dioxan-2-yl)-7-hydroxy-1-benzopyran-2-one IUPAC Name: 6-bromo-4-(5,5-dimethyl-4-phenyl-1,3-dioxan-2-yl)-7-hydroxychromen-2-one Traditional Name: 6-bromo-4-(5,5-dimethyl-4-phenyl-1,3-dioxan-2-yl)-7-hydroxy-coumarin Formula: C21H19BrO5 MolecularWeight: 431.27656

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1C2=CC=CC=C2)C3=CC(=O)OC4=CC(=C(C=C34)Br)O)C

Isomeric SMILES

CC1(COC(OC1C2=CC=CC=C2)C3=CC(=O)OC4=CC(=C(C=C34)Br)O)C

InChI

InChI=1S/C21H19BrO5/c1-21(2)11-25-20(27-19(21)12-6-4-3-5-7-12)14-9-18(24)26-17-10-16(23)15(22)8-13(14)17/h3-10,19-20,23H,11H2,1-2H3