diazanium 2-dodecyl-4-(4-sulfonatophenoxy)benzenesulfonate

Systemtic Name: diazanium 2-dodecyl-4-(4-sulfonatophenoxy)benzenesulfonate Openeye Name: diammonium 2-dodecyl-4-(4-sulfonatophenoxy)benzenesulfonate CAS Name: diammonium 2-dodecyl-4-(4-sulfonatophenoxy)benzenesulfonate IUPAC Name: diazanium 2-dodecyl-4-(4-sulfonatophenoxy)benzenesulfonate Traditional Name: diammonium 2-lauryl-4-(4-sulfonatophenoxy)besylate Formula: C24H40N2O7S2 MolecularWeight: 532.7136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C(C=CC(=C1)OC2=CC=C(C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[NH4+].[NH4+]

Isomeric SMILES

CCCCCCCCCCCCC1=C(C=CC(=C1)OC2=CC=C(C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-].[NH4+].[NH4+]

InChI

InChI=1S/C24H34O7S2.2H3N/c1-2-3-4-5-6-7-8-9-10-11-12-20-19-22(15-18-24(20)33(28,29)30)31-21-13-16-23(17-14-21)32(25,26)27;;/h13-19H,2-12H2,1H3,(H,25,26,27)(H,28,29,30);2*1H3