N-(2-diethylaminoethyl)-3-(phenylsulfonylmethyl)piperidine-1-carboxamide; ethanedioic acid

Systemtic Name: N-(2-diethylaminoethyl)-3-(phenylsulfonylmethyl)piperidine-1-carboxamide; ethanedioic acid Openeye Name: 3-(benzenesulfonylmethyl)-N-(2-diethylaminoethyl)piperidine-1-carboxamide; oxalic acid CAS Name: 3-(benzenesulfonylmethyl)-N-(2-diethylaminoethyl)-1-piperidinecarboxamide; oxalic acid IUPAC Name: 3-(benzenesulfonylmethyl)-N-(2-diethylaminoethyl)piperidine-1-carboxamide; oxalic acid Traditional Name: 3-(besylmethyl)-N-(2-diethylaminoethyl)piperidine-1-carboxamide; oxalic acid Formula: C21H33N3O7S MolecularWeight: 471.56762

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)N1CCCC(C1)CS(=O)(=O)C2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC)CCNC(=O)N1CCCC(C1)CS(=O)(=O)C2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H31N3O3S.C2H2O4/c1-3-21(4-2)14-12-20-19(23)22-13-8-9-17(15-22)16-26(24,25)18-10-6-5-7-11-18;3-1(4)2(5)6/h5-7,10-11,17H,3-4,8-9,12-16H2,1-2H3,(H,20,23);(H,3,4)(H,5,6)