5-[2-(4-bromophenyl)-2-oxidanylidene-ethoxy]-7-methyl-4-propyl-chromen-2-one

Systemtic Name: 5-[2-(4-bromophenyl)-2-oxidanylidene-ethoxy]-7-methyl-4-propyl-chromen-2-one Openeye Name: 5-[2-(4-bromophenyl)-2-oxo-ethoxy]-7-methyl-4-propyl-chromen-2-one CAS Name: 5-[2-(4-bromophenyl)-2-oxoethoxy]-7-methyl-4-propyl-1-benzopyran-2-one IUPAC Name: 5-[2-(4-bromophenyl)-2-oxoethoxy]-7-methyl-4-propylchromen-2-one Traditional Name: 5-[2-(4-bromophenyl)-2-keto-ethoxy]-7-methyl-4-propyl-coumarin Formula: C21H19BrO4 MolecularWeight: 415.27716

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H19BrO4/c1-3-4-15-11-20(24)26-19-10-13(2)9-18(21(15)19)25-12-17(23)14-5-7-16(22)8-6-14/h5-11H,3-4,12H2,1-2H3