(3-morpholin-4-ylsulfonylphenyl)methyl 2-methoxy-5-methyl-benzoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 2-methoxy-5-methyl-benzoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 2-methoxy-5-methyl-benzoate CAS Name: 2-methoxy-5-methylbenzoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 2-methoxy-5-methylbenzoate Traditional Name: 2-methoxy-5-methyl-benzoic acid (3-morpholinosulfonylbenzyl) ester Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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