ethyl 3-methyl-5-[2-(4-methylphenyl)pyrrolidin-1-yl]sulfonyl-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-[2-(4-methylphenyl)pyrrolidin-1-yl]sulfonyl-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-methyl-5-[2-(p-tolyl)pyrrolidin-1-yl]sulfonyl-benzofuran-2-carboxylate CAS Name: 3-methyl-5-[[2-(4-methylphenyl)-1-pyrrolidinyl]sulfonyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[2-(4-methylphenyl)pyrrolidin-1-yl]sulfonyl-1-benzofuran-2-carboxylate Traditional Name: 3-methyl-5-[2-(p-tolyl)pyrrolidino]sulfonyl-coumarilic acid ethyl ester Formula: C23H25NO5S MolecularWeight: 427.5133

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)S(=O)(=O)N3CCCC3C4=CC=C(C=C4)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)S(=O)(=O)N3CCCC3C4=CC=C(C=C4)C)C

InChI

InChI=1S/C23H25NO5S/c1-4-28-23(25)22-16(3)19-14-18(11-12-21(19)29-22)30(26,27)24-13-5-6-20(24)17-9-7-15(2)8-10-17/h7-12,14,20H,4-6,13H2,1-3H3