4-ethoxy-5-methoxy-2-nitro-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzamide

Systemtic Name: 4-ethoxy-5-methoxy-2-nitro-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzamide Openeye Name: 4-ethoxy-5-methoxy-2-nitro-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzamide CAS Name: 4-ethoxy-5-methoxy-2-nitro-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)benzamide IUPAC Name: 4-ethoxy-5-methoxy-2-nitro-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylbenzamide Traditional Name: 4-ethoxy-5-methoxy-2-nitro-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-benzamide Formula: C21H22N2O7 MolecularWeight: 414.40858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4)OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4)OC

InChI

InChI=1S/C21H22N2O7/c1-3-28-18-12-15(23(25)26)14(11-17(18)27-2)20(24)22-13-6-7-16-19(10-13)30-21(29-16)8-4-5-9-21/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,22,24)