N-[(1-methylpyrazol-4-yl)methyl]-3-nitro-benzamide

Systemtic Name: N-[(1-methylpyrazol-4-yl)methyl]-3-nitro-benzamide Openeye Name: N-[(1-methylpyrazol-4-yl)methyl]-3-nitro-benzamide CAS Name: N-[(1-methyl-4-pyrazolyl)methyl]-3-nitrobenzamide IUPAC Name: N-[(1-methylpyrazol-4-yl)methyl]-3-nitrobenzamide Traditional Name: N-[(1-methylpyrazol-4-yl)methyl]-3-nitro-benzamide Formula: C12H12N4O3 MolecularWeight: 260.24868

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=N1)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O3/c1-15-8-9(7-14-15)6-13-12(17)10-3-2-4-11(5-10)16(18)19/h2-5,7-8H,6H2,1H3,(H,13,17)