(3-morpholin-4-ylsulfonylphenyl)methyl 3,4-diethoxybenzoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3,4-diethoxybenzoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 3,4-diethoxybenzoate CAS Name: 3,4-diethoxybenzoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3,4-diethoxybenzoate Traditional Name: 3,4-diethoxybenzoic acid (3-morpholinosulfonylbenzyl) ester Formula: C22H27NO7S MolecularWeight: 449.51728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)OCC

InChI

InChI=1S/C22H27NO7S/c1-3-28-20-9-8-18(15-21(20)29-4-2)22(24)30-16-17-6-5-7-19(14-17)31(25,26)23-10-12-27-13-11-23/h5-9,14-15H,3-4,10-13,16H2,1-2H3