2,3,4,5-tetratert-butylnaphthalene-1-sulfonate

Systemtic Name: 2,3,4,5-tetratert-butylnaphthalene-1-sulfonate Openeye Name: 2,3,4,5-tetratert-butylnaphthalene-1-sulfonate CAS Name: 2,3,4,5-tetratert-butyl-1-naphthalenesulfonate IUPAC Name: 2,3,4,5-tetratert-butylnaphthalene-1-sulfonate Traditional Name: 2,3,4,5-tetratert-butylnaphthalene-1-sulfonate Formula: C26H39O3S- MolecularWeight: 431.65106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC2=C1C(=C(C(=C2S(=O)(=O)[O-])C(C)(C)C)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=CC2=C1C(=C(C(=C2S(=O)(=O)[O-])C(C)(C)C)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C26H40O3S/c1-23(2,3)17-15-13-14-16-18(17)19(24(4,5)6)20(25(7,8)9)21(26(10,11)12)22(16)30(27,28)29/h13-15H,1-12H3,(H,27,28,29)/p-1