N-[(1S,2S)-2-azidocycloheptyl]-3,5-bis(trifluoromethyl)benzamide

Systemtic Name: N-[(1S,2S)-2-azidocycloheptyl]-3,5-bis(trifluoromethyl)benzamide Openeye Name: N-[(1S,2S)-2-azidocycloheptyl]-3,5-bis(trifluoromethyl)benzamide CAS Name: N-[(1S,2S)-2-azidocycloheptyl]-3,5-bis(trifluoromethyl)benzamide IUPAC Name: N-[(1S,2S)-2-azidocycloheptyl]-3,5-bis(trifluoromethyl)benzamide Traditional Name: N-[(1S,2S)-2-azidocycloheptyl]-3,5-bis(trifluoromethyl)benzamide Formula: C16H16F6N4O MolecularWeight: 394.314859

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(CC1)N=[N+]=[N-])NC(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CC[C@@H]([C@H](CC1)N=[N+]=[N-])NC(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C16H16F6N4O/c17-15(18,19)10-6-9(7-11(8-10)16(20,21)22)14(27)24-12-4-2-1-3-5-13(12)25-26-23/h6-8,12-13H,1-5H2,(H,24,27)/t12-,13-/m0/s1