2-(4-tert-butylphenoxy)-N-(3-nitro-4-piperazin-1-yl-phenyl)ethanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-N-(3-nitro-4-piperazin-1-yl-phenyl)ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-(3-nitro-4-piperazin-1-yl-phenyl)acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[3-nitro-4-(1-piperazinyl)phenyl]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-(3-nitro-4-piperazin-1-ylphenyl)acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-(3-nitro-4-piperazino-phenyl)acetamide Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC2=CC(=C(C=C2)N3CCNCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC2=CC(=C(C=C2)N3CCNCC3)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O4/c1-22(2,3)16-4-7-18(8-5-16)30-15-21(27)24-17-6-9-19(20(14-17)26(28)29)25-12-10-23-11-13-25/h4-9,14,23H,10-13,15H2,1-3H3,(H,24,27)