ethyl 5-[4-[(1-phenylcyclopropyl)methylcarbamoyl]piperidin-1-yl]sulfonylfuran-2-carboxylate

Systemtic Name: ethyl 5-[4-[(1-phenylcyclopropyl)methylcarbamoyl]piperidin-1-yl]sulfonylfuran-2-carboxylate Openeye Name: ethyl 5-[[4-[(1-phenylcyclopropyl)methylcarbamoyl]-1-piperidyl]sulfonyl]furan-2-carboxylate CAS Name: 5-[[4-[oxo-[(1-phenylcyclopropyl)methylamino]methyl]-1-piperidinyl]sulfonyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-[(1-phenylcyclopropyl)methylcarbamoyl]piperidin-1-yl]sulfonylfuran-2-carboxylate Traditional Name: 5-[4-[(1-phenylcyclopropyl)methylcarbamoyl]piperidino]sulfonylfuran-2-carboxylic acid ethyl ester Formula: C23H28N2O6S MolecularWeight: 460.54322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H28N2O6S/c1-2-30-22(27)19-8-9-20(31-19)32(28,29)25-14-10-17(11-15-25)21(26)24-16-23(12-13-23)18-6-4-3-5-7-18/h3-9,17H,2,10-16H2,1H3,(H,24,26)