sodium 2-(2-methylpropyl)naphthalene-1-sulfonic acid

Systemtic Name: sodium 2-(2-methylpropyl)naphthalene-1-sulfonic acid Openeye Name: sodium 2-isobutylnaphthalene-1-sulfonic acid CAS Name: sodium 2-(2-methylpropyl)-1-naphthalenesulfonic acid IUPAC Name: sodium 2-(2-methylpropyl)naphthalene-1-sulfonic acid Traditional Name: sodium 2-isobutylnaphthalene-1-sulfonic acid Formula: C14H16NaO3S+ MolecularWeight: 287.32981

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)O.[Na+]

Isomeric SMILES

CC(C)CC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)O.[Na+]

InChI

InChI=1S/C14H16O3S.Na/c1-10(2)9-12-8-7-11-5-3-4-6-13(11)14(12)18(15,16)17;/h3-8,10H,9H2,1-2H3,(H,15,16,17);/q;+1