methyl 5-[(4-ethylphenyl)sulfonylamino]-2-(methoxymethyl)-1-benzofuran-3-carboxylate

Systemtic Name: methyl 5-[(4-ethylphenyl)sulfonylamino]-2-(methoxymethyl)-1-benzofuran-3-carboxylate Openeye Name: methyl 5-[(4-ethylphenyl)sulfonylamino]-2-(methoxymethyl)benzofuran-3-carboxylate CAS Name: 5-[(4-ethylphenyl)sulfonylamino]-2-(methoxymethyl)-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-ethylphenyl)sulfonylamino]-2-(methoxymethyl)-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-ethylphenyl)sulfonylamino]-2-(methoxymethyl)benzofuran-3-carboxylic acid methyl ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC(=C3C(=O)OC)COC

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC(=C3C(=O)OC)COC

InChI

InChI=1S/C20H21NO6S/c1-4-13-5-8-15(9-6-13)28(23,24)21-14-7-10-17-16(11-14)19(20(22)26-3)18(27-17)12-25-2/h5-11,21H,4,12H2,1-3H3