(3-morpholin-4-ylsulfonylphenyl)methyl 3-methoxy-4-methyl-benzoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3-methoxy-4-methyl-benzoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 3-methoxy-4-methyl-benzoate CAS Name: 3-methoxy-4-methylbenzoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3-methoxy-4-methylbenzoate Traditional Name: 3-methoxy-4-methyl-benzoic acid (3-morpholinosulfonylbenzyl) ester Formula: C20H23NO6S MolecularWeight: 405.46472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)OC

InChI

InChI=1S/C20H23NO6S/c1-15-6-7-17(13-19(15)25-2)20(22)27-14-16-4-3-5-18(12-16)28(23,24)21-8-10-26-11-9-21/h3-7,12-13H,8-11,14H2,1-2H3