2-dodecylbenzenesulfonate; (4-nitrophenyl)-phenyl-iodanium

Systemtic Name: 2-dodecylbenzenesulfonate; (4-nitrophenyl)-phenyl-iodanium Openeye Name: 2-dodecylbenzenesulfonate; (4-nitrophenyl)-phenyl-iodonium CAS Name: 2-dodecylbenzenesulfonate; (4-nitrophenyl)-phenyliodonium IUPAC Name: 2-dodecylbenzenesulfonate; (4-nitrophenyl)-phenyliodanium Traditional Name: 2-laurylbesylate; (4-nitrophenyl)-phenyl-iodonium Formula: C30H38INO5S MolecularWeight: 651.59589

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].C1=CC=C(C=C1)[I+]C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].C1=CC=C(C=C1)[I+]C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H30O3S.C12H9INO2/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21;15-14(16)12-8-6-11(7-9-12)13-10-4-2-1-3-5-10/h12-13,15-16H,2-11,14H2,1H3,(H,19,20,21);1-9H/q;+1/p-1