[4,4-diethoxy-2-[(4-methylphenyl)sulfonyloxymethyl]butyl] ethanoate

Systemtic Name: [4,4-diethoxy-2-[(4-methylphenyl)sulfonyloxymethyl]butyl] ethanoate Openeye Name: [4,4-diethoxy-2-(p-tolylsulfonyloxymethyl)butyl] acetate CAS Name: acetic acid [4,4-diethoxy-2-[(4-methylphenyl)sulfonyloxymethyl]butyl] ester IUPAC Name: [4,4-diethoxy-2-[(4-methylphenyl)sulfonyloxymethyl]butyl] acetate Traditional Name: acetic acid [4,4-diethoxy-2-(tosyloxymethyl)butyl] ester Formula: C18H28O7S MolecularWeight: 388.47572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC(COC(=O)C)COS(=O)(=O)C1=CC=C(C=C1)C)OCC

Isomeric SMILES

CCOC(CC(COC(=O)C)COS(=O)(=O)C1=CC=C(C=C1)C)OCC

InChI

InChI=1S/C18H28O7S/c1-5-22-18(23-6-2)11-16(12-24-15(4)19)13-25-26(20,21)17-9-7-14(3)8-10-17/h7-10,16,18H,5-6,11-13H2,1-4H3