(4-methylsulfanylphenyl)methyl 3-morpholin-4-ylsulfonylbenzoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 3-morpholin-4-ylsulfonylbenzoate Openeye Name: (4-methylsulfanylphenyl)methyl 3-morpholinosulfonylbenzoate CAS Name: 3-(4-morpholinylsulfonyl)benzoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 3-morpholin-4-ylsulfonylbenzoate Traditional Name: 3-morpholinosulfonylbenzoic acid [4-(methylthio)benzyl] ester Formula: C19H21NO5S2 MolecularWeight: 407.50374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CSC1=CC=C(C=C1)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H21NO5S2/c1-26-17-7-5-15(6-8-17)14-25-19(21)16-3-2-4-18(13-16)27(22,23)20-9-11-24-12-10-20/h2-8,13H,9-12,14H2,1H3