ethyl 4-[4-(3-morpholin-4-ylpropylcarbamoyl)piperidin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(3-morpholin-4-ylpropylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[[4-(3-morpholinopropylcarbamoyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[4-[[3-(4-morpholinyl)propylamino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(3-morpholin-4-ylpropylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(3-morpholinopropylcarbamoyl)piperidino]sulfonylbenzoic acid ethyl ester Formula: C22H33N3O6S MolecularWeight: 467.57892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCCN3CCOCC3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCCN3CCOCC3

InChI

InChI=1S/C22H33N3O6S/c1-2-31-22(27)19-4-6-20(7-5-19)32(28,29)25-12-8-18(9-13-25)21(26)23-10-3-11-24-14-16-30-17-15-24/h4-7,18H,2-3,8-17H2,1H3,(H,23,26)