(5-methoxy-5-oxidanylidene-1-phenyl-pentyl) 4-bromanylbenzoate

Systemtic Name: (5-methoxy-5-oxidanylidene-1-phenyl-pentyl) 4-bromanylbenzoate Openeye Name: (5-methoxy-5-oxo-1-phenyl-pentyl) 4-bromobenzoate CAS Name: 4-bromobenzoic acid (5-methoxy-5-oxo-1-phenylpentyl) ester IUPAC Name: (5-methoxy-5-oxo-1-phenylpentyl) 4-bromobenzoate Traditional Name: 4-bromobenzoic acid (5-keto-5-methoxy-1-phenyl-pentyl) ester Formula: C19H19BrO4 MolecularWeight: 391.25576

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

COC(=O)CCCC(C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C19H19BrO4/c1-23-18(21)9-5-8-17(14-6-3-2-4-7-14)24-19(22)15-10-12-16(20)13-11-15/h2-4,6-7,10-13,17H,5,8-9H2,1H3