2-(3-methylbutyl)naphthalene-1-sulfonic acid

Systemtic Name: 2-(3-methylbutyl)naphthalene-1-sulfonic acid Openeye Name: 2-isopentylnaphthalene-1-sulfonic acid CAS Name: 2-(3-methylbutyl)-1-naphthalenesulfonic acid IUPAC Name: 2-(3-methylbutyl)naphthalene-1-sulfonic acid Traditional Name: 2-isoamylnaphthalene-1-sulfonic acid Formula: C15H18O3S MolecularWeight: 278.36662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)O

Isomeric SMILES

CC(C)CCC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)O

InChI

InChI=1S/C15H18O3S/c1-11(2)7-8-13-10-9-12-5-3-4-6-14(12)15(13)19(16,17)18/h3-6,9-11H,7-8H2,1-2H3,(H,16,17,18)