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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O5/c1-15-18(7-4-8-19(15)25(27)28)23-22(26)13-24(17-5-2-3-6-17)12-16-9-10-20-21(11-16)30-14-29-20/h4,7-11,17H,2-3,5-6,12-14H2,1H3,(H,23,26)