N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-methoxy-4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-methoxy-4-nitropyrazol-1-yl)acetamide Traditional Name: N-homoveratryl-2-(3-methoxy-4-nitro-pyrazol-1-yl)acetamide Formula: C16H20N4O6 MolecularWeight: 364.3532

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CN2C=C(C(=N2)OC)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CN2C=C(C(=N2)OC)[N+](=O)[O-])OC

InChI

InChI=1S/C16H20N4O6/c1-24-13-5-4-11(8-14(13)25-2)6-7-17-15(21)10-19-9-12(20(22)23)16(18-19)26-3/h4-5,8-9H,6-7,10H2,1-3H3,(H,17,21)