3,6-ditert-butylnaphthalene-1-sulfonic acid

Systemtic Name: 3,6-ditert-butylnaphthalene-1-sulfonic acid Openeye Name: 3,6-ditert-butylnaphthalene-1-sulfonic acid CAS Name: 3,6-ditert-butyl-1-naphthalenesulfonic acid IUPAC Name: 3,6-ditert-butylnaphthalene-1-sulfonic acid Traditional Name: 3,6-ditert-butylnaphthalene-1-sulfonic acid Formula: C18H24O3S MolecularWeight: 320.44636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=CC(=CC(=C2C=C1)S(=O)(=O)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC2=CC(=CC(=C2C=C1)S(=O)(=O)O)C(C)(C)C

InChI

InChI=1S/C18H24O3S/c1-17(2,3)13-7-8-15-12(9-13)10-14(18(4,5)6)11-16(15)22(19,20)21/h7-11H,1-6H3,(H,19,20,21)