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

Systemtic Name: 4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-3-nitro-benzamide Openeye Name: 4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-3-nitro-benzamide CAS Name: 4-methyl-N-[(1-methyl-4-pyrazolyl)methyl]-3-nitrobenzamide IUPAC Name: 4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-3-nitrobenzamide Traditional Name: 4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-3-nitro-benzamide Formula: C13H14N4O3 MolecularWeight: 274.27526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC2=CN(N=C2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC2=CN(N=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O3/c1-9-3-4-11(5-12(9)17(19)20)13(18)14-6-10-7-15-16(2)8-10/h3-5,7-8H,6H2,1-2H3,(H,14,18)