4-nonylnaphthalene-1,2,3-trisulfonic acid

Systemtic Name: 4-nonylnaphthalene-1,2,3-trisulfonic acid Openeye Name: 4-nonylnaphthalene-1,2,3-trisulfonic acid CAS Name: 4-nonylnaphthalene-1,2,3-trisulfonic acid IUPAC Name: 4-nonylnaphthalene-1,2,3-trisulfonic acid Traditional Name: 4-nonylnaphthalene-1,2,3-trisulfonic acid Formula: C19H26O9S3 MolecularWeight: 494.59934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C(=C(C2=CC=CC=C21)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCC1=C(C(=C(C2=CC=CC=C21)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C19H26O9S3/c1-2-3-4-5-6-7-8-12-15-14-11-9-10-13-16(14)18(30(23,24)25)19(31(26,27)28)17(15)29(20,21)22/h9-11,13H,2-8,12H2,1H3,(H,20,21,22)(H,23,24,25)(H,26,27,28)