N-(5-chloranyl-2-piperidin-1-yl-phenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-piperidin-1-yl-phenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carboxamide Openeye Name: N-[5-chloro-2-(1-piperidyl)phenyl]-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carboxamide CAS Name: N-[5-chloro-2-(1-piperidinyl)phenyl]-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(5-chloro-2-piperidin-1-ylphenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carboxamide Traditional Name: N-(5-chloro-2-piperidino-phenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)isonipecotamide Formula: C25H30ClN3O5S MolecularWeight: 520.0408

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C25H30ClN3O5S/c26-19-4-6-22(28-10-2-1-3-11-28)21(16-19)27-25(30)18-8-12-29(13-9-18)35(31,32)20-5-7-23-24(17-20)34-15-14-33-23/h4-7,16-18H,1-3,8-15H2,(H,27,30)