[3-(4-bromophenyl)-2-methyl-4-oxidanylidene-chromen-7-yl] thiophene-2-carboxylate

Systemtic Name: [3-(4-bromophenyl)-2-methyl-4-oxidanylidene-chromen-7-yl] thiophene-2-carboxylate Openeye Name: [3-(4-bromophenyl)-2-methyl-4-oxo-chromen-7-yl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [3-(4-bromophenyl)-2-methyl-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-bromophenyl)-2-methyl-4-oxochromen-7-yl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [3-(4-bromophenyl)-4-keto-2-methyl-chromen-7-yl] ester Formula: C21H13BrO4S MolecularWeight: 441.29452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC=CS3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=CC=CS3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H13BrO4S/c1-12-19(13-4-6-14(22)7-5-13)20(23)16-9-8-15(11-17(16)25-12)26-21(24)18-3-2-10-27-18/h2-11H,1H3