[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-oxidanylidene-8-prop-2-enyl-chromene-3-carboxylate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-oxidanylidene-8-prop-2-enyl-chromene-3-carboxylate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 8-allyl-2-oxo-chromene-3-carboxylate CAS Name: 2-oxo-8-prop-2-enyl-1-benzopyran-3-carboxylic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2-oxo-8-prop-2-enylchromene-3-carboxylate Traditional Name: 8-allyl-2-keto-chromene-3-carboxylic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C21H15BrO5 MolecularWeight: 427.2448

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC2=C1OC(=O)C(=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C=CCC1=CC=CC2=C1OC(=O)C(=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H15BrO5/c1-2-4-14-5-3-6-15-11-17(21(25)27-19(14)15)20(24)26-12-18(23)13-7-9-16(22)10-8-13/h2-3,5-11H,1,4,12H2