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

Systemtic Name: ethyl 3-methyl-5-[2-(3-methylphenyl)pyrrolidin-1-yl]sulfonyl-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-methyl-5-[2-(m-tolyl)pyrrolidin-1-yl]sulfonyl-benzofuran-2-carboxylate CAS Name: 3-methyl-5-[[2-(3-methylphenyl)-1-pyrrolidinyl]sulfonyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[2-(3-methylphenyl)pyrrolidin-1-yl]sulfonyl-1-benzofuran-2-carboxylate Traditional Name: 3-methyl-5-[2-(m-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(=CC=C4)C)C

Isomeric SMILES

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

InChI

InChI=1S/C23H25NO5S/c1-4-28-23(25)22-16(3)19-14-18(10-11-21(19)29-22)30(26,27)24-12-6-9-20(24)17-8-5-7-15(2)13-17/h5,7-8,10-11,13-14,20H,4,6,9,12H2,1-3H3