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

Systemtic Name: N-(tert-butylcarbamoyl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]propanamide Openeye Name: N-(tert-butylcarbamoyl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]propanamide CAS Name: N-[(tert-butylamino)-oxomethyl]-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]propanamide IUPAC Name: N-(tert-butylcarbamoyl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]propanamide Traditional Name: N-(tert-butylcarbamoyl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]propionamide Formula: C19H26F3N5O4 MolecularWeight: 445.43605

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC(C)(C)C)N1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC(=O)NC(C)(C)C)N1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H26F3N5O4/c1-12(16(28)23-17(29)24-18(2,3)4)25-7-9-26(10-8-25)14-6-5-13(19(20,21)22)11-15(14)27(30)31/h5-6,11-12H,7-10H2,1-4H3,(H2,23,24,28,29)