[6-chloranyl-2-(3,4-dimethoxyphenyl)-7-methyl-4-oxidanylidene-chromen-3-yl] 3-bromanylbenzoate

Systemtic Name: [6-chloranyl-2-(3,4-dimethoxyphenyl)-7-methyl-4-oxidanylidene-chromen-3-yl] 3-bromanylbenzoate Openeye Name: [6-chloro-2-(3,4-dimethoxyphenyl)-7-methyl-4-oxo-chromen-3-yl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [6-chloro-2-(3,4-dimethoxyphenyl)-7-methyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [6-chloro-2-(3,4-dimethoxyphenyl)-7-methyl-4-oxochromen-3-yl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [6-chloro-2-(3,4-dimethoxyphenyl)-4-keto-7-methyl-chromen-3-yl] ester Formula: C25H18BrClO6 MolecularWeight: 529.76382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CC(=CC=C3)Br)C4=CC(=C(C=C4)OC)OC)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CC(=CC=C3)Br)C4=CC(=C(C=C4)OC)OC)Cl

InChI

InChI=1S/C25H18BrClO6/c1-13-9-20-17(12-18(13)27)22(28)24(33-25(29)15-5-4-6-16(26)10-15)23(32-20)14-7-8-19(30-2)21(11-14)31-3/h4-12H,1-3H3