methyl 4-[[4-[(E)-3-(4-bromophenyl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[4-[(E)-3-(4-bromophenyl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoate Openeye Name: methyl 4-[[4-[(E)-3-(4-bromophenyl)-3-oxo-prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoate CAS Name: 4-[[4-[(E)-3-(4-bromophenyl)-3-oxoprop-1-enyl]-2-methoxyphenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(E)-3-(4-bromophenyl)-3-oxoprop-1-enyl]-2-methoxyphenoxy]methyl]benzoate Traditional Name: 4-[[4-[(E)-3-(4-bromophenyl)-3-keto-prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoic acid methyl ester Formula: C25H21BrO5 MolecularWeight: 481.33524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)C2=CC=C(C=C2)Br)OCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)C2=CC=C(C=C2)Br)OCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C25H21BrO5/c1-29-24-15-17(5-13-22(27)19-9-11-21(26)12-10-19)6-14-23(24)31-16-18-3-7-20(8-4-18)25(28)30-2/h3-15H,16H2,1-2H3/b13-5+