ethyl 6-bromanyl-4-oxidanylidene-2-(3-propan-2-yloxyphenyl)chromene-8-carboxylate

Systemtic Name: ethyl 6-bromanyl-4-oxidanylidene-2-(3-propan-2-yloxyphenyl)chromene-8-carboxylate Openeye Name: ethyl 6-bromo-2-(3-isopropoxyphenyl)-4-oxo-chromene-8-carboxylate CAS Name: 6-bromo-4-oxo-2-(3-propan-2-yloxyphenyl)-1-benzopyran-8-carboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-4-oxo-2-(3-propan-2-yloxyphenyl)chromene-8-carboxylate Traditional Name: 6-bromo-2-(3-isopropoxyphenyl)-4-keto-chromene-8-carboxylic acid ethyl ester Formula: C21H19BrO5 MolecularWeight: 431.27656

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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)OC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H19BrO5/c1-4-25-21(24)17-10-14(22)9-16-18(23)11-19(27-20(16)17)13-6-5-7-15(8-13)26-12(2)3/h5-12H,4H2,1-3H3