3,4,5-trimethoxy-2-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzamide

Systemtic Name: 3,4,5-trimethoxy-2-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Openeye Name: 3,4,5-trimethoxy-2-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzamide CAS Name: 3,4,5-trimethoxy-2-nitro-N-[(1-phenyl-4-pyrazolyl)methyl]benzamide IUPAC Name: 3,4,5-trimethoxy-2-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Traditional Name: 3,4,5-trimethoxy-2-nitro-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Formula: C20H20N4O6 MolecularWeight: 412.396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NCC2=CN(N=C2)C3=CC=CC=C3)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)NCC2=CN(N=C2)C3=CC=CC=C3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C20H20N4O6/c1-28-16-9-15(17(24(26)27)19(30-3)18(16)29-2)20(25)21-10-13-11-22-23(12-13)14-7-5-4-6-8-14/h4-9,11-12H,10H2,1-3H3,(H,21,25)