2,3-diheptylnaphthalene-1-sulfonic acid

Systemtic Name: 2,3-diheptylnaphthalene-1-sulfonic acid Openeye Name: 2,3-diheptylnaphthalene-1-sulfonic acid CAS Name: 2,3-diheptyl-1-naphthalenesulfonic acid IUPAC Name: 2,3-diheptylnaphthalene-1-sulfonic acid Traditional Name: 2,3-diheptylnaphthalene-1-sulfonic acid Formula: C24H36O3S MolecularWeight: 404.60584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCC)S(=O)(=O)O

Isomeric SMILES

CCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCC)S(=O)(=O)O

InChI

InChI=1S/C24H36O3S/c1-3-5-7-9-11-15-20-19-21-16-13-14-18-23(21)24(28(25,26)27)22(20)17-12-10-8-6-4-2/h13-14,16,18-19H,3-12,15,17H2,1-2H3,(H,25,26,27)