N-(1,3-benzodioxol-5-yl)-1-[1-(phenylsulfonyl)piperidin-4-yl]carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[1-(phenylsulfonyl)piperidin-4-yl]carbonyl-piperidine-4-carboxamide Openeye Name: 1-[1-(benzenesulfonyl)piperidine-4-carbonyl]-N-(1,3-benzodioxol-5-yl)piperidine-4-carboxamide CAS Name: 1-[[1-(benzenesulfonyl)-4-piperidinyl]-oxomethyl]-N-(1,3-benzodioxol-5-yl)-4-piperidinecarboxamide IUPAC Name: 1-[1-(benzenesulfonyl)piperidine-4-carbonyl]-N-(1,3-benzodioxol-5-yl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(1-besylisonipecotoyl)isonipecotamide Formula: C25H29N3O6S MolecularWeight: 499.57926

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H29N3O6S/c29-24(26-20-6-7-22-23(16-20)34-17-33-22)18-8-12-27(13-9-18)25(30)19-10-14-28(15-11-19)35(31,32)21-4-2-1-3-5-21/h1-7,16,18-19H,8-15,17H2,(H,26,29)