ethyl 6-bromanyl-3-(3-chloranylpropoxy)-4-oxidanylidene-2-phenyl-chromene-8-carboxylate

Systemtic Name: ethyl 6-bromanyl-3-(3-chloranylpropoxy)-4-oxidanylidene-2-phenyl-chromene-8-carboxylate Openeye Name: ethyl 6-bromo-3-(3-chloropropoxy)-4-oxo-2-phenyl-chromene-8-carboxylate CAS Name: 6-bromo-3-(3-chloropropoxy)-4-oxo-2-phenyl-1-benzopyran-8-carboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-3-(3-chloropropoxy)-4-oxo-2-phenylchromene-8-carboxylate Traditional Name: 6-bromo-3-(3-chloropropoxy)-4-keto-2-phenyl-chromene-8-carboxylic acid ethyl ester Formula: C21H18BrClO5 MolecularWeight: 465.72162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=CC(=C1)Br)C(=O)C(=C(O2)C3=CC=CC=C3)OCCCCl

Isomeric SMILES

CCOC(=O)C1=C2C(=CC(=C1)Br)C(=O)C(=C(O2)C3=CC=CC=C3)OCCCCl

InChI

InChI=1S/C21H18BrClO5/c1-2-26-21(25)16-12-14(22)11-15-17(24)20(27-10-6-9-23)18(28-19(15)16)13-7-4-3-5-8-13/h3-5,7-8,11-12H,2,6,9-10H2,1H3