methyl 2-(1-tridecoxyethylsulfanyl)benzoate

Systemtic Name: methyl 2-(1-tridecoxyethylsulfanyl)benzoate Openeye Name: methyl 2-(1-tridecoxyethylsulfanyl)benzoate CAS Name: 2-(1-tridecoxyethylthio)benzoic acid methyl ester IUPAC Name: methyl 2-(1-tridecoxyethylsulfanyl)benzoate Traditional Name: 2-(1-tridecoxyethylthio)benzoic acid methyl ester Formula: C23H38O3S MolecularWeight: 394.61102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC(C)SC1=CC=CC=C1C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCOC(C)SC1=CC=CC=C1C(=O)OC

InChI

InChI=1S/C23H38O3S/c1-4-5-6-7-8-9-10-11-12-13-16-19-26-20(2)27-22-18-15-14-17-21(22)23(24)25-3/h14-15,17-18,20H,4-13,16,19H2,1-3H3