N-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[1-[(4-ethylphenoxy)methyl]-4-pyrazolyl]-2,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]-2,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C18H20N6O4 MolecularWeight: 384.3892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCN2C=C(C=N2)NC(=O)C3=C(C(=NN3C)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)OCN2C=C(C=N2)NC(=O)C3=C(C(=NN3C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H20N6O4/c1-4-13-5-7-15(8-6-13)28-11-23-10-14(9-19-23)20-18(25)17-16(24(26)27)12(2)21-22(17)3/h5-10H,4,11H2,1-3H3,(H,20,25)