N-(4-acetamidophenyl)-1-methyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-(4-acetamidophenyl)-1-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-(4-acetamidophenyl)-1-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-(4-acetamidophenyl)-1-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-(4-acetamidophenyl)-1-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(4-acetamidophenyl)-1-methyl-4-nitro-pyrazole-3-carboxamide Formula: C13H13N5O4 MolecularWeight: 303.27342

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=NN(C=C2[N+](=O)[O-])C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=NN(C=C2[N+](=O)[O-])C

InChI

InChI=1S/C13H13N5O4/c1-8(19)14-9-3-5-10(6-4-9)15-13(20)12-11(18(21)22)7-17(2)16-12/h3-7H,1-2H3,(H,14,19)(H,15,20)