dipotassium 4-[4-ethyl-3-(4-sulfonatobutoxy)phenoxy]butane-1-sulfonate

Systemtic Name: dipotassium 4-[4-ethyl-3-(4-sulfonatobutoxy)phenoxy]butane-1-sulfonate Openeye Name: dipotassium 4-[4-ethyl-3-(4-sulfonatobutoxy)phenoxy]butane-1-sulfonate CAS Name: dipotassium 4-[4-ethyl-3-(4-sulfonatobutoxy)phenoxy]-1-butanesulfonate IUPAC Name: dipotassium 4-[4-ethyl-3-(4-sulfonatobutoxy)phenoxy]butane-1-sulfonate Traditional Name: dipotassium 4-[4-ethyl-3-(4-sulfonatobutoxy)phenoxy]butane-1-sulfonate Formula: C16H24K2O8S2 MolecularWeight: 486.68356

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)OCCCCS(=O)(=O)[O-])OCCCCS(=O)(=O)[O-].[K+].[K+]

Isomeric SMILES

CCC1=C(C=C(C=C1)OCCCCS(=O)(=O)[O-])OCCCCS(=O)(=O)[O-].[K+].[K+]

InChI

InChI=1S/C16H26O8S2.2K/c1-2-14-7-8-15(23-9-3-5-11-25(17,18)19)13-16(14)24-10-4-6-12-26(20,21)22;;/h7-8,13H,2-6,9-12H2,1H3,(H,17,18,19)(H,20,21,22);;/q;2*+1/p-2