tert-butyl 4-(3-iodanyl-5-methoxy-4-propoxy-phenyl)-4-oxidanylidene-butanoate

Systemtic Name: tert-butyl 4-(3-iodanyl-5-methoxy-4-propoxy-phenyl)-4-oxidanylidene-butanoate Openeye Name: tert-butyl 4-(3-iodo-5-methoxy-4-propoxy-phenyl)-4-oxo-butanoate CAS Name: 4-(3-iodo-5-methoxy-4-propoxyphenyl)-4-oxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-iodo-5-methoxy-4-propoxyphenyl)-4-oxobutanoate Traditional Name: 4-(3-iodo-5-methoxy-4-propoxy-phenyl)-4-keto-butyric acid tert-butyl ester Formula: C18H25IO5 MolecularWeight: 448.29257

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1I)C(=O)CCC(=O)OC(C)(C)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1I)C(=O)CCC(=O)OC(C)(C)C)OC

InChI

InChI=1S/C18H25IO5/c1-6-9-23-17-13(19)10-12(11-15(17)22-5)14(20)7-8-16(21)24-18(2,3)4/h10-11H,6-9H2,1-5H3