[4-(3-bromophenyl)-7-chloranyl-6-methyl-2H-chromen-3-yl] 2-oxidanylidenebutanoate

Systemtic Name: [4-(3-bromophenyl)-7-chloranyl-6-methyl-2H-chromen-3-yl] 2-oxidanylidenebutanoate Openeye Name: [4-(3-bromophenyl)-7-chloro-6-methyl-2H-chromen-3-yl] 2-oxobutanoate CAS Name: 2-oxobutanoic acid [4-(3-bromophenyl)-7-chloro-6-methyl-2H-1-benzopyran-3-yl] ester IUPAC Name: [4-(3-bromophenyl)-7-chloro-6-methyl-2H-chromen-3-yl] 2-oxobutanoate Traditional Name: 2-ketobutyric acid [4-(3-bromophenyl)-7-chloro-6-methyl-2H-chromen-3-yl] ester Formula: C20H16BrClO4 MolecularWeight: 435.69564

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(=O)OC1=C(C2=CC(=C(C=C2OC1)Cl)C)C3=CC(=CC=C3)Br

Isomeric SMILES

CCC(=O)C(=O)OC1=C(C2=CC(=C(C=C2OC1)Cl)C)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H16BrClO4/c1-3-16(23)20(24)26-18-10-25-17-9-15(22)11(2)7-14(17)19(18)12-5-4-6-13(21)8-12/h4-9H,3,10H2,1-2H3