4-decyl-2-[(Z)-octadec-9-enyl]benzenesulfonic acid

Systemtic Name: 4-decyl-2-[(Z)-octadec-9-enyl]benzenesulfonic acid Openeye Name: 4-decyl-2-[(Z)-octadec-9-enyl]benzenesulfonic acid CAS Name: 4-decyl-2-[(Z)-octadec-9-enyl]benzenesulfonic acid IUPAC Name: 4-decyl-2-[(Z)-octadec-9-enyl]benzenesulfonic acid Traditional Name: 4-decyl-2-[(Z)-octadec-9-enyl]besylic acid Formula: C34H60O3S MolecularWeight: 548.9034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC(=C(C=C1)S(=O)(=O)O)CCCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCC1=CC(=C(C=C1)S(=O)(=O)O)CCCCCCCC/C=C\CCCCCCCC

InChI

InChI=1S/C34H60O3S/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-22-24-26-28-33-31-32(29-30-34(33)38(35,36)37)27-25-23-21-12-10-8-6-4-2/h15-16,29-31H,3-14,17-28H2,1-2H3,(H,35,36,37)/b16-15-