ethyl 5-[4-(4-phenylbutan-2-ylcarbamoyl)piperidin-1-yl]sulfonylfuran-2-carboxylate

Systemtic Name: ethyl 5-[4-(4-phenylbutan-2-ylcarbamoyl)piperidin-1-yl]sulfonylfuran-2-carboxylate Openeye Name: ethyl 5-[[4-[(1-methyl-3-phenyl-propyl)carbamoyl]-1-piperidyl]sulfonyl]furan-2-carboxylate CAS Name: 5-[[4-[oxo-(4-phenylbutan-2-ylamino)methyl]-1-piperidinyl]sulfonyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-(4-phenylbutan-2-ylcarbamoyl)piperidin-1-yl]sulfonylfuran-2-carboxylate Traditional Name: 5-[4-[(1-methyl-3-phenyl-propyl)carbamoyl]piperidino]sulfonylfuran-2-carboxylic acid ethyl ester Formula: C23H30N2O6S MolecularWeight: 462.5591

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)CCC3=CC=CC=C3

InChI

InChI=1S/C23H30N2O6S/c1-3-30-23(27)20-11-12-21(31-20)32(28,29)25-15-13-19(14-16-25)22(26)24-17(2)9-10-18-7-5-4-6-8-18/h4-8,11-12,17,19H,3,9-10,13-16H2,1-2H3,(H,24,26)