4-ethoxy-3-nitro-N-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]benzamide

Systemtic Name: 4-ethoxy-3-nitro-N-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]benzamide Openeye Name: 4-ethoxy-3-nitro-N-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]benzamide CAS Name: 4-ethoxy-3-nitro-N-[4-[(1,3,5-trimethyl-4-pyrazolyl)methyl]phenyl]benzamide IUPAC Name: 4-ethoxy-3-nitro-N-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]benzamide Traditional Name: 4-ethoxy-3-nitro-N-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]benzamide Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)CC3=C(N(N=C3C)C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)CC3=C(N(N=C3C)C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O4/c1-5-30-21-11-8-17(13-20(21)26(28)29)22(27)23-18-9-6-16(7-10-18)12-19-14(2)24-25(4)15(19)3/h6-11,13H,5,12H2,1-4H3,(H,23,27)