3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-N-phenyl-propanamide

Systemtic Name: 3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-N-phenyl-propanamide Openeye Name: 3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-N-phenyl-propanamide CAS Name: 3-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-N-phenylpropanamide IUPAC Name: 3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-N-phenylpropanamide Traditional Name: 3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]-N-phenyl-propionamide Formula: C20H21F3N4O3 MolecularWeight: 422.40095

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC2=CC=CC=C2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCC(=O)NC2=CC=CC=C2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H21F3N4O3/c21-20(22,23)15-6-7-17(18(14-15)27(29)30)26-12-10-25(11-13-26)9-8-19(28)24-16-4-2-1-3-5-16/h1-7,14H,8-13H2,(H,24,28)