[2-(3-iodanylphenyl)-2-oxidanylidene-ethyl] 4-decoxybenzoate

Systemtic Name: [2-(3-iodanylphenyl)-2-oxidanylidene-ethyl] 4-decoxybenzoate Openeye Name: [2-(3-iodophenyl)-2-oxo-ethyl] 4-decoxybenzoate CAS Name: 4-decoxybenzoic acid [2-(3-iodophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-iodophenyl)-2-oxoethyl] 4-decoxybenzoate Traditional Name: 4-decoxybenzoic acid [2-(3-iodophenyl)-2-keto-ethyl] ester Formula: C25H31IO4 MolecularWeight: 522.41571

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC(=CC=C2)I

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC(=CC=C2)I

InChI

InChI=1S/C25H31IO4/c1-2-3-4-5-6-7-8-9-17-29-23-15-13-20(14-16-23)25(28)30-19-24(27)21-11-10-12-22(26)18-21/h10-16,18H,2-9,17,19H2,1H3