N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-(4-pyrazol-1-ylphenyl)ethanamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-(4-pyrazol-1-ylphenyl)ethanamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-(4-pyrazol-1-ylphenyl)acetamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2-[4-(1-pyrazolyl)phenyl]acetamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2-(4-pyrazol-1-ylphenyl)acetamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-(4-pyrazol-1-ylphenyl)acetamide Formula: C21H22N4O5 MolecularWeight: 410.42318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)CC2=CC=C(C=C2)N3C=CC=N3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)CC2=CC=C(C=C2)N3C=CC=N3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H22N4O5/c1-29-19-13-16(18(25(27)28)14-20(19)30-2)8-10-22-21(26)12-15-4-6-17(7-5-15)24-11-3-9-23-24/h3-7,9,11,13-14H,8,10,12H2,1-2H3,(H,22,26)