azanium 2,3-ditert-butylnaphthalene-1-sulfonate

Systemtic Name: azanium 2,3-ditert-butylnaphthalene-1-sulfonate Openeye Name: ammonium 2,3-ditert-butylnaphthalene-1-sulfonate CAS Name: ammonium 2,3-ditert-butyl-1-naphthalenesulfonate IUPAC Name: azanium 2,3-ditert-butylnaphthalene-1-sulfonate Traditional Name: ammonium 2,3-ditert-butylnaphthalene-1-sulfonate Formula: C18H27NO3S MolecularWeight: 337.47688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=CC=CC=C2C(=C1C(C)(C)C)S(=O)(=O)[O-].[NH4+]

Isomeric SMILES

CC(C)(C)C1=CC2=CC=CC=C2C(=C1C(C)(C)C)S(=O)(=O)[O-].[NH4+]

InChI

InChI=1S/C18H24O3S.H3N/c1-17(2,3)14-11-12-9-7-8-10-13(12)16(22(19,20)21)15(14)18(4,5)6;/h7-11H,1-6H3,(H,19,20,21);1H3