4-iodanylbutyl 4-hexoxy-3,5-dimethyl-benzoate

Systemtic Name: 4-iodanylbutyl 4-hexoxy-3,5-dimethyl-benzoate Openeye Name: 4-iodobutyl 4-hexoxy-3,5-dimethyl-benzoate CAS Name: 4-hexoxy-3,5-dimethylbenzoic acid 4-iodobutyl ester IUPAC Name: 4-iodobutyl 4-hexoxy-3,5-dimethylbenzoate Traditional Name: 4-hexoxy-3,5-dimethyl-benzoic acid 4-iodobutyl ester Formula: C19H29IO3 MolecularWeight: 432.33623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1C)C(=O)OCCCCI)C

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1C)C(=O)OCCCCI)C

InChI

InChI=1S/C19H29IO3/c1-4-5-6-8-11-22-18-15(2)13-17(14-16(18)3)19(21)23-12-9-7-10-20/h13-14H,4-12H2,1-3H3