(4-aminocarbonyl-2-nitro-phenyl)methyl 3-fluoranyl-4-methyl-benzoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 3-fluoranyl-4-methyl-benzoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 3-fluoro-4-methyl-benzoate CAS Name: 3-fluoro-4-methylbenzoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 3-fluoro-4-methylbenzoate Traditional Name: 3-fluoro-4-methyl-benzoic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C16H13FN2O5 MolecularWeight: 332.283223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])F

InChI

InChI=1S/C16H13FN2O5/c1-9-2-3-11(6-13(9)17)16(21)24-8-12-5-4-10(15(18)20)7-14(12)19(22)23/h2-7H,8H2,1H3,(H2,18,20)