2-nonadecan-10-ylbenzenesulfonic acid

Systemtic Name: 2-nonadecan-10-ylbenzenesulfonic acid Openeye Name: 2-(1-nonyldecyl)benzenesulfonic acid CAS Name: 2-nonadecan-10-ylbenzenesulfonic acid IUPAC Name: 2-nonadecan-10-ylbenzenesulfonic acid Traditional Name: 2-(1-nonyldecyl)besylic acid Formula: C25H44O3S MolecularWeight: 424.68006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCCCCCCC)C1=CC=CC=C1S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCC(CCCCCCCCC)C1=CC=CC=C1S(=O)(=O)O

InChI

InChI=1S/C25H44O3S/c1-3-5-7-9-11-13-15-19-23(20-16-14-12-10-8-6-4-2)24-21-17-18-22-25(24)29(26,27)28/h17-18,21-23H,3-16,19-20H2,1-2H3,(H,26,27,28)