(3-morpholin-4-ylsulfonylphenyl)methyl 3-acetamidobenzoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3-acetamidobenzoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid (3-morpholinosulfonylbenzyl) ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H22N2O6S/c1-15(23)21-18-6-3-5-17(13-18)20(24)28-14-16-4-2-7-19(12-16)29(25,26)22-8-10-27-11-9-22/h2-7,12-13H,8-11,14H2,1H3,(H,21,23)