N-(1,3-benzodioxol-5-ylmethyl)-4-piperidin-1-yl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-piperidin-1-yl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(1-piperidyl)-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(1-piperidinyl)-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-piperidin-1-yl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-piperidino-3-piperidinosulfonyl-N-piperonyl-benzamide Formula: C25H31N3O5S MolecularWeight: 485.59574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C25H31N3O5S/c29-25(26-17-19-7-10-22-23(15-19)33-18-32-22)20-8-9-21(27-11-3-1-4-12-27)24(16-20)34(30,31)28-13-5-2-6-14-28/h7-10,15-16H,1-6,11-14,17-18H2,(H,26,29)