2,7-ditert-butylnaphthalene-1-sulfonic acid

Systemtic Name: 2,7-ditert-butylnaphthalene-1-sulfonic acid Openeye Name: 2,7-ditert-butylnaphthalene-1-sulfonic acid CAS Name: 2,7-ditert-butyl-1-naphthalenesulfonic acid IUPAC Name: 2,7-ditert-butylnaphthalene-1-sulfonic acid Traditional Name: 2,7-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=C(C=C1)C=CC(=C2S(=O)(=O)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)C=CC(=C2S(=O)(=O)O)C(C)(C)C

InChI

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