[2-(3-bromanyl-4,5-dimethoxy-phenyl)-4-oxidanylidene-chromen-3-yl] 4-methylbenzoate

Systemtic Name: [2-(3-bromanyl-4,5-dimethoxy-phenyl)-4-oxidanylidene-chromen-3-yl] 4-methylbenzoate Openeye Name: [2-(3-bromo-4,5-dimethoxy-phenyl)-4-oxo-chromen-3-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-(3-bromo-4,5-dimethoxyphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(3-bromo-4,5-dimethoxyphenyl)-4-oxochromen-3-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-(3-bromo-4,5-dimethoxy-phenyl)-4-keto-chromen-3-yl] ester Formula: C25H19BrO6 MolecularWeight: 495.31876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(OC3=CC=CC=C3C2=O)C4=CC(=C(C(=C4)Br)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(OC3=CC=CC=C3C2=O)C4=CC(=C(C(=C4)Br)OC)OC

InChI

InChI=1S/C25H19BrO6/c1-14-8-10-15(11-9-14)25(28)32-24-21(27)17-6-4-5-7-19(17)31-22(24)16-12-18(26)23(30-3)20(13-16)29-2/h4-13H,1-3H3