2-octadecylsulfanyloxybenzoate

Systemtic Name: 2-octadecylsulfanyloxybenzoate Openeye Name: 2-octadecylsulfanyloxybenzoate CAS Name: 2-(octadecylthio)oxybenzoate IUPAC Name: 2-octadecylsulfanyloxybenzoate Traditional Name: 2-(stearylthio)oxybenzoate Formula: C25H41O3S- MolecularWeight: 421.65624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSOC1=CC=CC=C1C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSOC1=CC=CC=C1C(=O)[O-]

InChI

InChI=1S/C25H42O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-29-28-24-21-18-17-20-23(24)25(26)27/h17-18,20-21H,2-16,19,22H2,1H3,(H,26,27)/p-1