2-heptadecanoylbenzenesulfonic acid

Systemtic Name: 2-heptadecanoylbenzenesulfonic acid Openeye Name: 2-heptadecanoylbenzenesulfonic acid CAS Name: 2-(1-oxoheptadecyl)benzenesulfonic acid IUPAC Name: 2-heptadecanoylbenzenesulfonic acid Traditional Name: 2-heptadecanoylbesylic acid Formula: C23H38O4S MolecularWeight: 410.61042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(=O)C1=CC=CC=C1S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(=O)C1=CC=CC=C1S(=O)(=O)O

InChI

InChI=1S/C23H38O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22(24)21-18-16-17-20-23(21)28(25,26)27/h16-18,20H,2-15,19H2,1H3,(H,25,26,27)