3-butyl-1-phenyl-nonane-1-sulfonic acid

Systemtic Name: 3-butyl-1-phenyl-nonane-1-sulfonic acid Openeye Name: 3-butyl-1-phenyl-nonane-1-sulfonic acid CAS Name: 3-butyl-1-phenyl-1-nonanesulfonic acid IUPAC Name: 3-butyl-1-phenylnonane-1-sulfonic acid Traditional Name: 3-butyl-1-phenyl-nonane-1-sulfonic acid Formula: C19H32O3S MolecularWeight: 340.52058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCC)CC(C1=CC=CC=C1)S(=O)(=O)O

Isomeric SMILES

CCCCCCC(CCCC)CC(C1=CC=CC=C1)S(=O)(=O)O

InChI

InChI=1S/C19H32O3S/c1-3-5-7-9-13-17(12-6-4-2)16-19(23(20,21)22)18-14-10-8-11-15-18/h8,10-11,14-15,17,19H,3-7,9,12-13,16H2,1-2H3,(H,20,21,22)