(2-chloranyl-6-fluoranyl-phenyl)methyl 3-methyl-4-nitro-benzoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 3-methyl-4-nitro-benzoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid (2-chloro-6-fluoro-benzyl) ester Formula: C15H11ClFNO4 MolecularWeight: 323.703543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OCC2=C(C=CC=C2Cl)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OCC2=C(C=CC=C2Cl)F)[N+](=O)[O-]

InChI

InChI=1S/C15H11ClFNO4/c1-9-7-10(5-6-14(9)18(20)21)15(19)22-8-11-12(16)3-2-4-13(11)17/h2-7H,8H2,1H3