[2-oxidanylidene-2-(4-phenylphenyl)ethyl] 3-bromanyl-5-ethoxy-4-propoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] 3-bromanyl-5-ethoxy-4-propoxy-benzoate Openeye Name: [2-oxo-2-(4-phenylphenyl)ethyl] 3-bromo-5-ethoxy-4-propoxy-benzoate CAS Name: 3-bromo-5-ethoxy-4-propoxybenzoic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] 3-bromo-5-ethoxy-4-propoxybenzoate Traditional Name: 3-bromo-5-ethoxy-4-propoxy-benzoic acid [2-keto-2-(4-phenylphenyl)ethyl] ester Formula: C26H25BrO5 MolecularWeight: 497.3777

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C(=O)OCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C(=O)OCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)OCC

InChI

InChI=1S/C26H25BrO5/c1-3-14-31-25-22(27)15-21(16-24(25)30-4-2)26(29)32-17-23(28)20-12-10-19(11-13-20)18-8-6-5-7-9-18/h5-13,15-16H,3-4,14,17H2,1-2H3