ethyl 2-butoxy-5-methyl-benzenesulfinate

Systemtic Name: ethyl 2-butoxy-5-methyl-benzenesulfinate Openeye Name: ethyl 2-butoxy-5-methyl-benzenesulfinate CAS Name: 2-butoxy-5-methylbenzenesulfinic acid ethyl ester IUPAC Name: ethyl 2-butoxy-5-methylbenzenesulfinate Traditional Name: 2-butoxy-5-methyl-benzenesulfinic acid ethyl ester Formula: C13H20O3S MolecularWeight: 256.3611

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C)S(=O)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C)S(=O)OCC

InChI

InChI=1S/C13H20O3S/c1-4-6-9-15-12-8-7-11(3)10-13(12)17(14)16-5-2/h7-8,10H,4-6,9H2,1-3H3