4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(3-piperidin-1-ylpropyl)butanamide

Systemtic Name: 4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(3-piperidin-1-ylpropyl)butanamide Openeye Name: 4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[3-(1-piperidyl)propyl]butanamide CAS Name: 4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[3-(1-piperidinyl)propyl]butanamide IUPAC Name: 4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(3-piperidin-1-ylpropyl)butanamide Traditional Name: 4-[1,3-benzodioxol-5-yl(mesyl)amino]-N-(3-piperidinopropyl)butyramide Formula: C20H31N3O5S MolecularWeight: 425.54224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC(=O)NCCCN1CCCCC1)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CS(=O)(=O)N(CCCC(=O)NCCCN1CCCCC1)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H31N3O5S/c1-29(25,26)23(17-8-9-18-19(15-17)28-16-27-18)14-5-7-20(24)21-10-6-13-22-11-3-2-4-12-22/h8-9,15H,2-7,10-14,16H2,1H3,(H,21,24)