N-[(5-nitro-2-oxidanyl-phenyl)methyl]-2-(1-phenylpyrazol-4-yl)ethanamide

Systemtic Name: N-[(5-nitro-2-oxidanyl-phenyl)methyl]-2-(1-phenylpyrazol-4-yl)ethanamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)methyl]-2-(1-phenylpyrazol-4-yl)acetamide CAS Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-2-(1-phenyl-4-pyrazolyl)acetamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-2-(1-phenylpyrazol-4-yl)acetamide Traditional Name: N-(2-hydroxy-5-nitro-benzyl)-2-(1-phenylpyrazol-4-yl)acetamide Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CC(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CC(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C18H16N4O4/c23-17-7-6-16(22(25)26)9-14(17)11-19-18(24)8-13-10-20-21(12-13)15-4-2-1-3-5-15/h1-7,9-10,12,23H,8,11H2,(H,19,24)