sodium 4,7-bis(2-methylpropyl)naphthalene-2-sulfonate

Systemtic Name: sodium 4,7-bis(2-methylpropyl)naphthalene-2-sulfonate Openeye Name: sodium 4,7-diisobutylnaphthalene-2-sulfonate CAS Name: sodium 4,7-bis(2-methylpropyl)-2-naphthalenesulfonate IUPAC Name: sodium 4,7-bis(2-methylpropyl)naphthalene-2-sulfonate Traditional Name: sodium 4,7-diisobutylnaphthalene-2-sulfonate Formula: C18H23NaO3S MolecularWeight: 342.42819

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC2=CC(=CC(=C2C=C1)CC(C)C)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC(C)CC1=CC2=CC(=CC(=C2C=C1)CC(C)C)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C18H24O3S.Na/c1-12(2)7-14-5-6-18-15(8-13(3)4)10-17(22(19,20)21)11-16(18)9-14;/h5-6,9-13H,7-8H2,1-4H3,(H,19,20,21);/q;+1/p-1