(2S)-N-cycloheptyl-2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propanamide

Systemtic Name: (2S)-N-cycloheptyl-2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propanamide Openeye Name: (2S)-N-cycloheptyl-2-[2-nitro-4-(trifluoromethyl)anilino]propanamide CAS Name: (2S)-N-cycloheptyl-2-[2-nitro-4-(trifluoromethyl)anilino]propanamide IUPAC Name: (2S)-N-cycloheptyl-2-[2-nitro-4-(trifluoromethyl)anilino]propanamide Traditional Name: (2S)-N-cycloheptyl-2-[2-nitro-4-(trifluoromethyl)anilino]propionamide Formula: C17H22F3N3O3 MolecularWeight: 373.37009

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCCC1)NC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NC1CCCCCC1)NC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H22F3N3O3/c1-11(16(24)22-13-6-4-2-3-5-7-13)21-14-9-8-12(17(18,19)20)10-15(14)23(25)26/h8-11,13,21H,2-7H2,1H3,(H,22,24)/t11-/m0/s1