2-(5-methyl-2-nitro-phenoxy)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-ethanamide

Systemtic Name: 2-(5-methyl-2-nitro-phenoxy)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-ethanamide Openeye Name: 2-(5-methyl-2-nitro-phenoxy)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-acetamide CAS Name: 2-(5-methyl-2-nitrophenoxy)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)acetamide IUPAC Name: 2-(5-methyl-2-nitrophenoxy)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylacetamide Traditional Name: 2-(5-methyl-2-nitro-phenoxy)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-acetamide Formula: C20H20N2O6 MolecularWeight: 384.3826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])OCC(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])OCC(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4

InChI

InChI=1S/C20H20N2O6/c1-13-4-6-15(22(24)25)17(10-13)26-12-19(23)21-14-5-7-16-18(11-14)28-20(27-16)8-2-3-9-20/h4-7,10-11H,2-3,8-9,12H2,1H3,(H,21,23)