methyl 2-[4-(2-diethylaminoethylcarbamoyl)piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-(2-diethylaminoethylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-(2-diethylaminoethylcarbamoyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[(2-diethylaminoethylamino)-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-(2-diethylaminoethylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-(2-diethylaminoethylcarbamoyl)piperidino]sulfonylbenzoic acid methyl ester Formula: C20H31N3O5S MolecularWeight: 425.54224

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)OC

Isomeric SMILES

CCN(CC)CCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C20H31N3O5S/c1-4-22(5-2)15-12-21-19(24)16-10-13-23(14-11-16)29(26,27)18-9-7-6-8-17(18)20(25)28-3/h6-9,16H,4-5,10-15H2,1-3H3,(H,21,24)