ethyl 5-[4-[(3-chlorophenyl)methylcarbamoyl]piperidin-1-yl]sulfonylfuran-2-carboxylate

Systemtic Name: ethyl 5-[4-[(3-chlorophenyl)methylcarbamoyl]piperidin-1-yl]sulfonylfuran-2-carboxylate Openeye Name: ethyl 5-[[4-[(3-chlorophenyl)methylcarbamoyl]-1-piperidyl]sulfonyl]furan-2-carboxylate CAS Name: 5-[[4-[[(3-chlorophenyl)methylamino]-oxomethyl]-1-piperidinyl]sulfonyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-[(3-chlorophenyl)methylcarbamoyl]piperidin-1-yl]sulfonylfuran-2-carboxylate Traditional Name: 5-[4-[(3-chlorobenzyl)carbamoyl]piperidino]sulfonylfuran-2-carboxylic acid ethyl ester Formula: C20H23ClN2O6S MolecularWeight: 454.92442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H23ClN2O6S/c1-2-28-20(25)17-6-7-18(29-17)30(26,27)23-10-8-15(9-11-23)19(24)22-13-14-4-3-5-16(21)12-14/h3-7,12,15H,2,8-11,13H2,1H3,(H,22,24)