2-(3,5-dimethylphenoxy)-N-(3-nitro-4-piperazin-1-yl-phenyl)ethanamide

Systemtic Name: 2-(3,5-dimethylphenoxy)-N-(3-nitro-4-piperazin-1-yl-phenyl)ethanamide Openeye Name: 2-(3,5-dimethylphenoxy)-N-(3-nitro-4-piperazin-1-yl-phenyl)acetamide CAS Name: 2-(3,5-dimethylphenoxy)-N-[3-nitro-4-(1-piperazinyl)phenyl]acetamide IUPAC Name: 2-(3,5-dimethylphenoxy)-N-(3-nitro-4-piperazin-1-ylphenyl)acetamide Traditional Name: 2-(3,5-dimethylphenoxy)-N-(3-nitro-4-piperazino-phenyl)acetamide Formula: C20H24N4O4 MolecularWeight: 384.42896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NC2=CC(=C(C=C2)N3CCNCC3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NC2=CC(=C(C=C2)N3CCNCC3)[N+](=O)[O-])C

InChI

InChI=1S/C20H24N4O4/c1-14-9-15(2)11-17(10-14)28-13-20(25)22-16-3-4-18(19(12-16)24(26)27)23-7-5-21-6-8-23/h3-4,9-12,21H,5-8,13H2,1-2H3,(H,22,25)