(5-ethanoyl-2-methoxy-phenyl)methyl 4-methyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 4-methyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 4-methyl-3-morpholinosulfonyl-benzoate CAS Name: 4-methyl-3-(4-morpholinylsulfonyl)benzoic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 4-methyl-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-methyl-3-morpholinosulfonyl-benzoic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C22H25NO7S MolecularWeight: 447.5014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO7S/c1-15-4-5-18(13-21(15)31(26,27)23-8-10-29-11-9-23)22(25)30-14-19-12-17(16(2)24)6-7-20(19)28-3/h4-7,12-13H,8-11,14H2,1-3H3