ethyl 3-(4-bromophenyl)-4-oxidanylidene-7-propanoyloxy-chromene-2-carboxylate

Systemtic Name: ethyl 3-(4-bromophenyl)-4-oxidanylidene-7-propanoyloxy-chromene-2-carboxylate Openeye Name: ethyl 3-(4-bromophenyl)-4-oxo-7-propanoyloxy-chromene-2-carboxylate CAS Name: 3-(4-bromophenyl)-4-oxo-7-(1-oxopropoxy)-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-bromophenyl)-4-oxo-7-propanoyloxychromene-2-carboxylate Traditional Name: 3-(4-bromophenyl)-4-keto-7-propionyloxy-chromene-2-carboxylic acid ethyl ester Formula: C21H17BrO6 MolecularWeight: 445.26008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(=O)OCC)C3=CC=C(C=C3)Br

Isomeric SMILES

CCC(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(=O)OCC)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H17BrO6/c1-3-17(23)27-14-9-10-15-16(11-14)28-20(21(25)26-4-2)18(19(15)24)12-5-7-13(22)8-6-12/h5-11H,3-4H2,1-2H3