ethyl 5-[4-[2-(4-tert-butylphenyl)ethylcarbamoyl]piperidin-1-yl]sulfonylfuran-2-carboxylate

Systemtic Name: ethyl 5-[4-[2-(4-tert-butylphenyl)ethylcarbamoyl]piperidin-1-yl]sulfonylfuran-2-carboxylate Openeye Name: ethyl 5-[[4-[2-(4-tert-butylphenyl)ethylcarbamoyl]-1-piperidyl]sulfonyl]furan-2-carboxylate CAS Name: 5-[[4-[[2-(4-tert-butylphenyl)ethylamino]-oxomethyl]-1-piperidinyl]sulfonyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-[2-(4-tert-butylphenyl)ethylcarbamoyl]piperidin-1-yl]sulfonylfuran-2-carboxylate Traditional Name: 5-[4-[2-(4-tert-butylphenyl)ethylcarbamoyl]piperidino]sulfonylfuran-2-carboxylic acid ethyl ester Formula: C25H34N2O6S MolecularWeight: 490.61226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C25H34N2O6S/c1-5-32-24(29)21-10-11-22(33-21)34(30,31)27-16-13-19(14-17-27)23(28)26-15-12-18-6-8-20(9-7-18)25(2,3)4/h6-11,19H,5,12-17H2,1-4H3,(H,26,28)