3-[(4-tert-butylphenoxy)methyl]-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide

Systemtic Name: 3-[(4-tert-butylphenoxy)methyl]-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide Openeye Name: 3-[(4-tert-butylphenoxy)methyl]-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide CAS Name: 3-[(4-tert-butylphenoxy)methyl]-N-[2-(4-nitro-1-pyrazolyl)ethyl]benzamide IUPAC Name: 3-[(4-tert-butylphenoxy)methyl]-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide Traditional Name: 3-[(4-tert-butylphenoxy)methyl]-N-[2-(4-nitropyrazol-1-yl)ethyl]benzamide Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)NCCN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)NCCN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C23H26N4O4/c1-23(2,3)19-7-9-21(10-8-19)31-16-17-5-4-6-18(13-17)22(28)24-11-12-26-15-20(14-25-26)27(29)30/h4-10,13-15H,11-12,16H2,1-3H3,(H,24,28)