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

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)ethanamide Openeye Name: N-[(3,4-diethoxyphenyl)methyl]-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)acetamide CAS Name: N-[(3,4-diethoxyphenyl)methyl]-2-(5-methyl-3,4-dinitro-1-pyrazolyl)acetamide IUPAC Name: N-[(3,4-diethoxyphenyl)methyl]-2-(5-methyl-3,4-dinitropyrazol-1-yl)acetamide Traditional Name: N-(3,4-diethoxybenzyl)-2-(5-methyl-3,4-dinitro-pyrazol-1-yl)acetamide Formula: C17H21N5O7 MolecularWeight: 407.37794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)CN2C(=C(C(=N2)[N+](=O)[O-])[N+](=O)[O-])C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)CN2C(=C(C(=N2)[N+](=O)[O-])[N+](=O)[O-])C)OCC

InChI

InChI=1S/C17H21N5O7/c1-4-28-13-7-6-12(8-14(13)29-5-2)9-18-15(23)10-20-11(3)16(21(24)25)17(19-20)22(26)27/h6-8H,4-5,9-10H2,1-3H3,(H,18,23)