2-(4-methyl-2-nitro-phenoxy)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-ethanamide

Systemtic Name: 2-(4-methyl-2-nitro-phenoxy)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-ethanamide Openeye Name: 2-(4-methyl-2-nitro-phenoxy)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-acetamide CAS Name: 2-(4-methyl-2-nitrophenoxy)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)acetamide IUPAC Name: 2-(4-methyl-2-nitrophenoxy)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylacetamide Traditional Name: 2-(4-methyl-2-nitro-phenoxy)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-acetamide Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NC2=CC3=C(C=C2)OC4(O3)CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NC2=CC3=C(C=C2)OC4(O3)CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H22N2O6/c1-14-5-7-17(16(11-14)23(25)26)27-13-20(24)22-15-6-8-18-19(12-15)29-21(28-18)9-3-2-4-10-21/h5-8,11-12H,2-4,9-10,13H2,1H3,(H,22,24)