N-[(3,4-diethoxyphenyl)methyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-[(3,4-diethoxyphenyl)methyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide CAS Name: N-[(3,4-diethoxyphenyl)methyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[(3,4-diethoxyphenyl)methyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-(3,4-diethoxybenzyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Formula: C16H20N4O6 MolecularWeight: 364.3532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2=C(C(=NN2)OC)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2=C(C(=NN2)OC)[N+](=O)[O-])OCC

InChI

InChI=1S/C16H20N4O6/c1-4-25-11-7-6-10(8-12(11)26-5-2)9-17-15(21)13-14(20(22)23)16(24-3)19-18-13/h6-8H,4-5,9H2,1-3H3,(H,17,21)(H,18,19)