N-(4-nitrophenyl)-3-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-(4-nitrophenyl)-3-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(4-nitrophenyl)-3-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propanamide CAS Name: N-(4-nitrophenyl)-3-[4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-(4-nitrophenyl)-3-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(4-nitrophenyl)-3-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazino]propionamide Formula: C20H21F3N4O5S MolecularWeight: 486.46475

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21F3N4O5S/c21-20(22,23)15-1-7-18(8-2-15)33(31,32)26-13-11-25(12-14-26)10-9-19(28)24-16-3-5-17(6-4-16)27(29)30/h1-8H,9-14H2,(H,24,28)