(5-ethanoyl-2-ethoxy-phenyl)methyl 2-chloranyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl 2-chloranyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl 2-chloro-5-morpholinosulfonyl-benzoate CAS Name: 2-chloro-5-(4-morpholinylsulfonyl)benzoic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl 2-chloro-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-chloro-5-morpholinosulfonyl-benzoic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C22H24ClNO7S MolecularWeight: 481.94646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

InChI

InChI=1S/C22H24ClNO7S/c1-3-30-21-7-4-16(15(2)25)12-17(21)14-31-22(26)19-13-18(5-6-20(19)23)32(27,28)24-8-10-29-11-9-24/h4-7,12-13H,3,8-11,14H2,1-2H3