(3-morpholin-4-ylsulfonylphenyl)methyl 3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3-methyl-1-benzofuran-2-carboxylate Openeye Name: (3-morpholinosulfonylphenyl)methyl 3-methylbenzofuran-2-carboxylate CAS Name: 3-methyl-2-benzofurancarboxylic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3-methyl-1-benzofuran-2-carboxylate Traditional Name: 3-methylcoumarilic acid (3-morpholinosulfonylbenzyl) ester Formula: C21H21NO6S MolecularWeight: 415.45954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)OCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)OCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H21NO6S/c1-15-18-7-2-3-8-19(18)28-20(15)21(23)27-14-16-5-4-6-17(13-16)29(24,25)22-9-11-26-12-10-22/h2-8,13H,9-12,14H2,1H3