ethyl 4-[4-(2-morpholin-4-ylethylcarbamoyl)piperidin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(2-morpholin-4-ylethylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[[4-(2-morpholinoethylcarbamoyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[4-[[2-(4-morpholinyl)ethylamino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(2-morpholin-4-ylethylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(2-morpholinoethylcarbamoyl)piperidino]sulfonylbenzoic acid ethyl ester Formula: C21H31N3O6S MolecularWeight: 453.55234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCN3CCOCC3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCN3CCOCC3

InChI

InChI=1S/C21H31N3O6S/c1-2-30-21(26)18-3-5-19(6-4-18)31(27,28)24-10-7-17(8-11-24)20(25)22-9-12-23-13-15-29-16-14-23/h3-6,17H,2,7-16H2,1H3,(H,22,25)