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

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(4-methyl-2-nitro-phenyl)ethanamide Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(4-methyl-2-nitro-phenyl)acetamide CAS Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(4-methyl-2-nitrophenyl)acetamide IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]-N-(4-methyl-2-nitrophenyl)acetamide Traditional Name: 2-[cyclopentyl(piperonyl)amino]-N-(4-methyl-2-nitro-phenyl)acetamide Formula: C22H25N3O5 MolecularWeight: 411.451

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CN(CC2=CC3=C(C=C2)OCO3)C4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CN(CC2=CC3=C(C=C2)OCO3)C4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H25N3O5/c1-15-6-8-18(19(10-15)25(27)28)23-22(26)13-24(17-4-2-3-5-17)12-16-7-9-20-21(11-16)30-14-29-20/h6-11,17H,2-5,12-14H2,1H3,(H,23,26)