ethyl 3-[[1-(4-methylphenyl)sulfonylpiperidin-3-yl]carbonylamino]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[[1-(4-methylphenyl)sulfonylpiperidin-3-yl]carbonylamino]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[1-(p-tolylsulfonyl)piperidine-3-carbonyl]amino]benzofuran-2-carboxylate CAS Name: 3-[[[1-(4-methylphenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[1-(4-methylphenyl)sulfonylpiperidine-3-carbonyl]amino]-1-benzofuran-2-carboxylate Traditional Name: 3-[(1-tosylnipecotoyl)amino]coumarilic acid ethyl ester Formula: C24H26N2O6S MolecularWeight: 470.53804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C24H26N2O6S/c1-3-31-24(28)22-21(19-8-4-5-9-20(19)32-22)25-23(27)17-7-6-14-26(15-17)33(29,30)18-12-10-16(2)11-13-18/h4-5,8-13,17H,3,6-7,14-15H2,1-2H3,(H,25,27)