docosyl 4-chloranylbenzenesulfonate

Systemtic Name: docosyl 4-chloranylbenzenesulfonate Openeye Name: docosyl 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid docosyl ester IUPAC Name: docosyl 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid behenyl ester Formula: C28H49ClO3S MolecularWeight: 501.20486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C28H49ClO3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26-32-33(30,31)28-24-22-27(29)23-25-28/h22-25H,2-21,26H2,1H3