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

Systemtic Name: 3-[2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]ethanoyl-phenyl-amino]propanamide Openeye Name: 3-(N-[2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]acetyl]anilino)propanamide CAS Name: 3-(N-[2-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-1-oxoethyl]anilino)propanamide IUPAC Name: 3-(N-[2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]acetyl]anilino)propanamide Traditional Name: 3-(N-[2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]acetyl]anilino)propionamide Formula: C22H24F3N5O4 MolecularWeight: 479.45227

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)N(CCC(=O)N)C2=CC=CC=C2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC(=O)N(CCC(=O)N)C2=CC=CC=C2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C22H24F3N5O4/c23-22(24,25)16-6-7-18(19(14-16)30(33)34)28-12-10-27(11-13-28)15-21(32)29(9-8-20(26)31)17-4-2-1-3-5-17/h1-7,14H,8-13,15H2,(H2,26,31)