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

Systemtic Name: 4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[3-(trifluoromethyloxy)phenyl]butanamide Openeye Name: 4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-[3-(trifluoromethoxy)phenyl]butanamide CAS Name: 4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-[3-(trifluoromethoxy)phenyl]butanamide IUPAC Name: 4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-[3-(trifluoromethoxy)phenyl]butanamide Traditional Name: 4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)-N-[3-(trifluoromethoxy)phenyl]butyramide Formula: C18H14F3N3O6 MolecularWeight: 425.31547

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(F)(F)F)NC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

C1=CC(=CC(=C1)OC(F)(F)F)NC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C18H14F3N3O6/c19-18(20,21)30-13-4-1-3-11(9-13)22-16(25)5-2-8-23-14-7-6-12(24(27)28)10-15(14)29-17(23)26/h1,3-4,6-7,9-10H,2,5,8H2,(H,22,25)