2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(4-fluoranyl-2-nitro-phenyl)ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(4-fluoranyl-2-nitro-phenyl)ethanamide Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(4-fluoro-2-nitro-phenyl)acetamide CAS Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(4-fluoro-2-nitrophenyl)acetamide IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(4-fluoro-2-nitrophenyl)acetamide Traditional Name: 2-[cyclopentyl(piperonyl)amino]-N-(4-fluoro-2-nitro-phenyl)acetamide Formula: C21H22FN3O5 MolecularWeight: 415.414883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=C(C=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=C(C=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C21H22FN3O5/c22-15-6-7-17(18(10-15)25(27)28)23-21(26)12-24(16-3-1-2-4-16)11-14-5-8-19-20(9-14)30-13-29-19/h5-10,16H,1-4,11-13H2,(H,23,26)