2,3-bis(2-ethyloctyl)naphthalene-1-sulfonic acid

Systemtic Name: 2,3-bis(2-ethyloctyl)naphthalene-1-sulfonic acid Openeye Name: 2,3-bis(2-ethyloctyl)naphthalene-1-sulfonic acid CAS Name: 2,3-bis(2-ethyloctyl)-1-naphthalenesulfonic acid IUPAC Name: 2,3-bis(2-ethyloctyl)naphthalene-1-sulfonic acid Traditional Name: 2,3-bis(2-ethyloctyl)naphthalene-1-sulfonic acid Formula: C30H48O3S MolecularWeight: 488.76532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC)CC1=CC2=CC=CC=C2C(=C1CC(CC)CCCCCC)S(=O)(=O)O

Isomeric SMILES

CCCCCCC(CC)CC1=CC2=CC=CC=C2C(=C1CC(CC)CCCCCC)S(=O)(=O)O

InChI

InChI=1S/C30H48O3S/c1-5-9-11-13-17-24(7-3)21-27-23-26-19-15-16-20-28(26)30(34(31,32)33)29(27)22-25(8-4)18-14-12-10-6-2/h15-16,19-20,23-25H,5-14,17-18,21-22H2,1-4H3,(H,31,32,33)