1-[3-[2-chloranyl-4-(trifluoromethyl)phenoxy]-6-methyl-6-nitro-cyclohexa-2,4-dien-1-yl]propan-1-one

Systemtic Name: 1-[3-[2-chloranyl-4-(trifluoromethyl)phenoxy]-6-methyl-6-nitro-cyclohexa-2,4-dien-1-yl]propan-1-one Openeye Name: 1-[3-[2-chloro-4-(trifluoromethyl)phenoxy]-6-methyl-6-nitro-cyclohexa-2,4-dien-1-yl]propan-1-one CAS Name: 1-[3-[2-chloro-4-(trifluoromethyl)phenoxy]-6-methyl-6-nitro-1-cyclohexa-2,4-dienyl]-1-propanone IUPAC Name: 1-[3-[2-chloro-4-(trifluoromethyl)phenoxy]-6-methyl-6-nitrocyclohexa-2,4-dien-1-yl]propan-1-one Traditional Name: 1-[3-[2-chloro-4-(trifluoromethyl)phenoxy]-6-methyl-6-nitro-cyclohexa-2,4-dien-1-yl]propan-1-one Formula: C17H15ClF3NO4 MolecularWeight: 389.75351

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1C=C(C=CC1(C)[N+](=O)[O-])OC2=C(C=C(C=C2)C(F)(F)F)Cl

Isomeric SMILES

CCC(=O)C1C=C(C=CC1(C)[N+](=O)[O-])OC2=C(C=C(C=C2)C(F)(F)F)Cl

InChI

InChI=1S/C17H15ClF3NO4/c1-3-14(23)12-9-11(6-7-16(12,2)22(24)25)26-15-5-4-10(8-13(15)18)17(19,20)21/h4-9,12H,3H2,1-2H3