1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-methyl-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-methyl-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperidine-4-carboxamide Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-methyl-N-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperidine-4-carboxamide CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-methyl-N-[2-oxo-2-(1-pyrrolidinyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)piperidine-4-carboxamide Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-(2-keto-2-pyrrolidino-ethyl)-N-methyl-isonipecotamide Formula: C22H31N3O6S MolecularWeight: 465.56304

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCCC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CN(CC(=O)N1CCCC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C22H31N3O6S/c1-23(16-21(26)24-9-2-3-10-24)22(27)17-7-11-25(12-8-17)32(28,29)18-5-6-19-20(15-18)31-14-4-13-30-19/h5-6,15,17H,2-4,7-14,16H2,1H3