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

Systemtic Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2-(3-nitropyrazol-1-yl)ethanamide Openeye Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2-(3-nitropyrazol-1-yl)acetamide CAS Name: N-[1-[(3,4-diethoxyphenyl)methyl]-4-pyrazolyl]-2-(3-nitro-1-pyrazolyl)acetamide IUPAC Name: N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2-(3-nitropyrazol-1-yl)acetamide Traditional Name: N-[1-(3,4-diethoxybenzyl)pyrazol-4-yl]-2-(3-nitropyrazol-1-yl)acetamide Formula: C19H22N6O5 MolecularWeight: 414.41518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)CN3C=CC(=N3)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)CN3C=CC(=N3)[N+](=O)[O-])OCC

InChI

InChI=1S/C19H22N6O5/c1-3-29-16-6-5-14(9-17(16)30-4-2)11-24-12-15(10-20-24)21-19(26)13-23-8-7-18(22-23)25(27)28/h5-10,12H,3-4,11,13H2,1-2H3,(H,21,26)