(1-butylsulfanyl-3-methoxy-propan-2-yl) benzoate

Systemtic Name: (1-butylsulfanyl-3-methoxy-propan-2-yl) benzoate Openeye Name: [1-(butylsulfanylmethyl)-2-methoxy-ethyl] benzoate CAS Name: benzoic acid [1-(butylthio)-3-methoxypropan-2-yl] ester IUPAC Name: (1-butylsulfanyl-3-methoxypropan-2-yl) benzoate Traditional Name: benzoic acid [1-[(butylthio)methyl]-2-methoxy-ethyl] ester Formula: C15H22O3S MolecularWeight: 282.39838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC(COC)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCSCC(COC)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C15H22O3S/c1-3-4-10-19-12-14(11-17-2)18-15(16)13-8-6-5-7-9-13/h5-9,14H,3-4,10-12H2,1-2H3