(3-morpholin-4-ylsulfonylphenyl)methyl 7-chloranyl-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 7-chloranyl-3-methyl-1-benzofuran-2-carboxylate Openeye Name: (3-morpholinosulfonylphenyl)methyl 7-chloro-3-methyl-benzofuran-2-carboxylate CAS Name: 7-chloro-3-methyl-2-benzofurancarboxylic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 7-chloro-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 7-chloro-3-methyl-coumarilic acid (3-morpholinosulfonylbenzyl) ester Formula: C21H20ClNO6S MolecularWeight: 449.9046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=CC=C2Cl)C(=O)OCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(OC2=C1C=CC=C2Cl)C(=O)OCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H20ClNO6S/c1-14-17-6-3-7-18(22)20(17)29-19(14)21(24)28-13-15-4-2-5-16(12-15)30(25,26)23-8-10-27-11-9-23/h2-7,12H,8-11,13H2,1H3