1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)piperidine-4-carboxamide

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)piperidine-4-carboxamide Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)piperidine-4-carboxamide CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-phenyl-2-(1-pyrrolidinyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(2-phenyl-2-pyrrolidin-1-ylethyl)piperidine-4-carboxamide Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(2-phenyl-2-pyrrolidino-ethyl)isonipecotamide Formula: C26H33N3O5S MolecularWeight: 499.62232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5

InChI

InChI=1S/C26H33N3O5S/c30-26(27-19-23(28-12-4-5-13-28)20-6-2-1-3-7-20)21-10-14-29(15-11-21)35(31,32)22-8-9-24-25(18-22)34-17-16-33-24/h1-3,6-9,18,21,23H,4-5,10-17,19H2,(H,27,30)