4-(1-iodanyldodecyl)benzenesulfonic acid

Systemtic Name: 4-(1-iodanyldodecyl)benzenesulfonic acid Openeye Name: 4-(1-iodododecyl)benzenesulfonic acid CAS Name: 4-(1-iodododecyl)benzenesulfonic acid IUPAC Name: 4-(1-iodododecyl)benzenesulfonic acid Traditional Name: 4-(1-iodododecyl)besylic acid Formula: C18H29IO3S MolecularWeight: 452.39053

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C1=CC=C(C=C1)S(=O)(=O)O)I

Isomeric SMILES

CCCCCCCCCCCC(C1=CC=C(C=C1)S(=O)(=O)O)I

InChI

InChI=1S/C18H29IO3S/c1-2-3-4-5-6-7-8-9-10-11-18(19)16-12-14-17(15-13-16)23(20,21)22/h12-15,18H,2-11H2,1H3,(H,20,21,22)