4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]butanamide

Systemtic Name: 4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]butanamide Openeye Name: 4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]butanamide CAS Name: 4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-[2-(1-pyrrolidinyl)-5-(trifluoromethyl)phenyl]butanamide IUPAC Name: 4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]butanamide Traditional Name: 4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)-N-[2-pyrrolidino-5-(trifluoromethyl)phenyl]butyramide Formula: C22H21F3N4O5 MolecularWeight: 478.42115

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C22H21F3N4O5/c23-22(24,25)14-5-7-17(27-9-1-2-10-27)16(12-14)26-20(30)4-3-11-28-18-8-6-15(29(32)33)13-19(18)34-21(28)31/h5-8,12-13H,1-4,9-11H2,(H,26,30)