6-bromanyl-3-[4-(4-methoxyphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-2-yl]chromen-2-one

Systemtic Name: 6-bromanyl-3-[4-(4-methoxyphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-2-yl]chromen-2-one Openeye Name: 6-bromo-3-[4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-2-yl]chromen-2-one CAS Name: 6-bromo-3-[4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-2-yl]-1-benzopyran-2-one IUPAC Name: 6-bromo-3-[4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-2-yl]chromen-2-one Traditional Name: 6-bromo-3-[5-keto-4-(4-methoxyphenyl)-7,7-dimethyl-6,8-dihydro-4H-chromen-2-yl]coumarin Formula: C27H23BrO5 MolecularWeight: 507.37252

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C=C(O2)C3=CC4=C(C=CC(=C4)Br)OC3=O)C5=CC=C(C=C5)OC)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C=C(O2)C3=CC4=C(C=CC(=C4)Br)OC3=O)C5=CC=C(C=C5)OC)C(=O)C1)C

InChI

InChI=1S/C27H23BrO5/c1-27(2)13-21(29)25-19(15-4-7-18(31-3)8-5-15)12-23(32-24(25)14-27)20-11-16-10-17(28)6-9-22(16)33-26(20)30/h4-12,19H,13-14H2,1-3H3