3,5-bis(iodanyl)-4-(15-methylhexadecylamino)benzoic acid

Systemtic Name: 3,5-bis(iodanyl)-4-(15-methylhexadecylamino)benzoic acid Openeye Name: 3,5-diiodo-4-(15-methylhexadecylamino)benzoic acid CAS Name: 3,5-diiodo-4-(15-methylhexadecylamino)benzoic acid IUPAC Name: 3,5-diiodo-4-(15-methylhexadecylamino)benzoic acid Traditional Name: 3,5-diiodo-4-(15-methylhexadecylamino)benzoic acid Formula: C24H39I2NO2 MolecularWeight: 627.3809

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCCNC1=C(C=C(C=C1I)C(=O)O)I

Isomeric SMILES

CC(C)CCCCCCCCCCCCCCNC1=C(C=C(C=C1I)C(=O)O)I

InChI

InChI=1S/C24H39I2NO2/c1-19(2)15-13-11-9-7-5-3-4-6-8-10-12-14-16-27-23-21(25)17-20(24(28)29)18-22(23)26/h17-19,27H,3-16H2,1-2H3,(H,28,29)