4-[bis(fluoranyl)methoxy]-N-[(1,3-diphenylpyrazol-4-yl)methyl]-5-methoxy-2-nitro-benzamide

Systemtic Name: 4-[bis(fluoranyl)methoxy]-N-[(1,3-diphenylpyrazol-4-yl)methyl]-5-methoxy-2-nitro-benzamide Openeye Name: 4-(difluoromethoxy)-N-[(1,3-diphenylpyrazol-4-yl)methyl]-5-methoxy-2-nitro-benzamide CAS Name: 4-(difluoromethoxy)-N-[(1,3-diphenyl-4-pyrazolyl)methyl]-5-methoxy-2-nitrobenzamide IUPAC Name: 4-(difluoromethoxy)-N-[(1,3-diphenylpyrazol-4-yl)methyl]-5-methoxy-2-nitrobenzamide Traditional Name: 4-(difluoromethoxy)-N-[(1,3-diphenylpyrazol-4-yl)methyl]-5-methoxy-2-nitro-benzamide Formula: C25H20F2N4O5 MolecularWeight: 494.446906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-])OC(F)F

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-])OC(F)F

InChI

InChI=1S/C25H20F2N4O5/c1-35-21-12-19(20(31(33)34)13-22(21)36-25(26)27)24(32)28-14-17-15-30(18-10-6-3-7-11-18)29-23(17)16-8-4-2-5-9-16/h2-13,15,25H,14H2,1H3,(H,28,32)