5-[(2-chloranyl-5-nitro-phenoxy)methyl]-N-[(1,3-diphenylpyrazol-4-yl)methyl]furan-2-carboxamide

Systemtic Name: 5-[(2-chloranyl-5-nitro-phenoxy)methyl]-N-[(1,3-diphenylpyrazol-4-yl)methyl]furan-2-carboxamide Openeye Name: 5-[(2-chloro-5-nitro-phenoxy)methyl]-N-[(1,3-diphenylpyrazol-4-yl)methyl]furan-2-carboxamide CAS Name: 5-[(2-chloro-5-nitrophenoxy)methyl]-N-[(1,3-diphenyl-4-pyrazolyl)methyl]-2-furancarboxamide IUPAC Name: 5-[(2-chloro-5-nitrophenoxy)methyl]-N-[(1,3-diphenylpyrazol-4-yl)methyl]furan-2-carboxamide Traditional Name: 5-[(2-chloro-5-nitro-phenoxy)methyl]-N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-furamide Formula: C28H21ClN4O5 MolecularWeight: 528.94314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)C3=CC=C(O3)COC4=C(C=CC(=C4)[N+](=O)[O-])Cl)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)C3=CC=C(O3)COC4=C(C=CC(=C4)[N+](=O)[O-])Cl)C5=CC=CC=C5

InChI

InChI=1S/C28H21ClN4O5/c29-24-13-11-22(33(35)36)15-26(24)37-18-23-12-14-25(38-23)28(34)30-16-20-17-32(21-9-5-2-6-10-21)31-27(20)19-7-3-1-4-8-19/h1-15,17H,16,18H2,(H,30,34)