N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanylidene-propyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanylidene-propyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxo-propyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[3-keto-3-(piperonylamino)propyl]isonipecotamide Formula: C23H27N3O6S MolecularWeight: 473.54198

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCC(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NCCC(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H27N3O6S/c27-22(25-15-17-6-7-20-21(14-17)32-16-31-20)8-11-24-23(28)18-9-12-26(13-10-18)33(29,30)19-4-2-1-3-5-19/h1-7,14,18H,8-13,15-16H2,(H,24,28)(H,25,27)