1-(4-nitrophenyl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(4-nitrophenyl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-pyrazole-4-carboxamide Openeye Name: 1-(4-nitrophenyl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-pyrazole-4-carboxamide CAS Name: 1-(4-nitrophenyl)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)-4-pyrazolecarboxamide IUPAC Name: 1-(4-nitrophenyl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylpyrazole-4-carboxamide Traditional Name: 1-(4-nitrophenyl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-pyrazole-4-carboxamide Formula: C22H20N4O5 MolecularWeight: 420.418

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)C4=CN(N=C4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)C4=CN(N=C4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H20N4O5/c27-21(15-13-23-25(14-15)17-5-7-18(8-6-17)26(28)29)24-16-4-9-19-20(12-16)31-22(30-19)10-2-1-3-11-22/h4-9,12-14H,1-3,10-11H2,(H,24,27)