N-[(1,3-diphenylpyrazol-4-yl)methyl]-4-nitro-3-oxidanyl-benzamide

Systemtic Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-4-nitro-3-oxidanyl-benzamide Openeye Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-hydroxy-4-nitro-benzamide CAS Name: N-[(1,3-diphenyl-4-pyrazolyl)methyl]-3-hydroxy-4-nitrobenzamide IUPAC Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-hydroxy-4-nitrobenzamide Traditional Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-3-hydroxy-4-nitro-benzamide Formula: C23H18N4O4 MolecularWeight: 414.41342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H18N4O4/c28-21-13-17(11-12-20(21)27(30)31)23(29)24-14-18-15-26(19-9-5-2-6-10-19)25-22(18)16-7-3-1-4-8-16/h1-13,15,28H,14H2,(H,24,29)