ethyl 7-(4-bromophenyl)carbonyloxy-3-(3,4-dimethoxyphenyl)-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: ethyl 7-(4-bromophenyl)carbonyloxy-3-(3,4-dimethoxyphenyl)-4-oxidanylidene-chromene-2-carboxylate Openeye Name: ethyl 7-(4-bromobenzoyl)oxy-3-(3,4-dimethoxyphenyl)-4-oxo-chromene-2-carboxylate CAS Name: 7-[(4-bromophenyl)-oxomethoxy]-3-(3,4-dimethoxyphenyl)-4-oxo-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-(4-bromobenzoyl)oxy-3-(3,4-dimethoxyphenyl)-4-oxochromene-2-carboxylate Traditional Name: 7-(4-bromobenzoyl)oxy-3-(3,4-dimethoxyphenyl)-4-keto-chromene-2-carboxylic acid ethyl ester Formula: C27H21BrO8 MolecularWeight: 553.35484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC=C(C=C3)Br)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC=C(C=C3)Br)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H21BrO8/c1-4-34-27(31)25-23(16-7-12-20(32-2)22(13-16)33-3)24(29)19-11-10-18(14-21(19)36-25)35-26(30)15-5-8-17(28)9-6-15/h5-14H,4H2,1-3H3