butyl 5-[(4-methoxyphenyl)sulfonylamino]-2,6-dimethyl-1-benzofuran-3-carboxylate

Systemtic Name: butyl 5-[(4-methoxyphenyl)sulfonylamino]-2,6-dimethyl-1-benzofuran-3-carboxylate Openeye Name: butyl 5-[(4-methoxyphenyl)sulfonylamino]-2,6-dimethyl-benzofuran-3-carboxylate CAS Name: 5-[(4-methoxyphenyl)sulfonylamino]-2,6-dimethyl-3-benzofurancarboxylic acid butyl ester IUPAC Name: butyl 5-[(4-methoxyphenyl)sulfonylamino]-2,6-dimethyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-methoxyphenyl)sulfonylamino]-2,6-dimethyl-benzofuran-3-carboxylic acid butyl ester Formula: C22H25NO6S MolecularWeight: 431.502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(OC2=CC(=C(C=C21)NS(=O)(=O)C3=CC=C(C=C3)OC)C)C

Isomeric SMILES

CCCCOC(=O)C1=C(OC2=CC(=C(C=C21)NS(=O)(=O)C3=CC=C(C=C3)OC)C)C

InChI

InChI=1S/C22H25NO6S/c1-5-6-11-28-22(24)21-15(3)29-20-12-14(2)19(13-18(20)21)23-30(25,26)17-9-7-16(27-4)8-10-17/h7-10,12-13,23H,5-6,11H2,1-4H3