N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)ethanamide

Systemtic Name: N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)ethanamide Openeye Name: N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)acetamide CAS Name: N-[1-[(3-methoxyphenyl)methyl]-4-pyrazolyl]-2-(5-methyl-3,4-dinitro-1-pyrazolyl)acetamide IUPAC Name: N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-2-(5-methyl-3,4-dinitropyrazol-1-yl)acetamide Traditional Name: N-(1-m-anisylpyrazol-4-yl)-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)acetamide Formula: C17H17N7O6 MolecularWeight: 415.36018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CN(N=C2)CC3=CC(=CC=C3)OC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CN(N=C2)CC3=CC(=CC=C3)OC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H17N7O6/c1-11-16(23(26)27)17(24(28)29)20-22(11)10-15(25)19-13-7-18-21(9-13)8-12-4-3-5-14(6-12)30-2/h3-7,9H,8,10H2,1-2H3,(H,19,25)