3,7-di(nonyl)-3H-naphthalene-1,7-disulfonic acid

Systemtic Name: 3,7-di(nonyl)-3H-naphthalene-1,7-disulfonic acid Openeye Name: 3,7-di(nonyl)-3H-naphthalene-1,7-disulfonic acid CAS Name: 3,7-di(nonyl)-3H-naphthalene-1,7-disulfonic acid IUPAC Name: 3,7-di(nonyl)-3H-naphthalene-1,7-disulfonic acid Traditional Name: 3,7-di(nonyl)-3H-naphthalene-1,7-disulfonic acid Formula: C28H46O6S2 MolecularWeight: 542.79124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1C=C2C=CC(C=C2C(=C1)S(=O)(=O)O)(CCCCCCCCC)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCC1C=C2C=CC(C=C2C(=C1)S(=O)(=O)O)(CCCCCCCCC)S(=O)(=O)O

InChI

InChI=1S/C28H46O6S2/c1-3-5-7-9-11-13-15-17-24-21-25-18-20-28(36(32,33)34,19-16-14-12-10-8-6-4-2)23-26(25)27(22-24)35(29,30)31/h18,20-24H,3-17,19H2,1-2H3,(H,29,30,31)(H,32,33,34)