(2-tetradecylphenyl) 3-sulfooxypropanoate

Systemtic Name: (2-tetradecylphenyl) 3-sulfooxypropanoate Openeye Name: (2-tetradecylphenyl) 3-sulfooxypropanoate CAS Name: 3-sulfooxypropanoic acid (2-tetradecylphenyl) ester IUPAC Name: (2-tetradecylphenyl) 3-sulfooxypropanoate Traditional Name: 3-sulfoxypropionic acid (2-myristylphenyl) ester Formula: C23H38O6S MolecularWeight: 442.60922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=CC=CC=C1OC(=O)CCOS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCC1=CC=CC=C1OC(=O)CCOS(=O)(=O)O

InChI

InChI=1S/C23H38O6S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21-17-14-15-18-22(21)29-23(24)19-20-28-30(25,26)27/h14-15,17-18H,2-13,16,19-20H2,1H3,(H,25,26,27)