[2-[(4-fluoranylphenoxy)methyl]-1,3-thiazol-4-yl]methyl 2-chloranyl-5-nitro-benzoate

Systemtic Name: [2-[(4-fluoranylphenoxy)methyl]-1,3-thiazol-4-yl]methyl 2-chloranyl-5-nitro-benzoate Openeye Name: [2-[(4-fluorophenoxy)methyl]thiazol-4-yl]methyl 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid [2-[(4-fluorophenoxy)methyl]-4-thiazolyl]methyl ester IUPAC Name: [2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]methyl 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid [2-[(4-fluorophenoxy)methyl]thiazol-4-yl]methyl ester Formula: C18H12ClFN2O5S MolecularWeight: 422.814683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC2=NC(=CS2)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)F

Isomeric SMILES

C1=CC(=CC=C1OCC2=NC(=CS2)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)F

InChI

InChI=1S/C18H12ClFN2O5S/c19-16-6-3-13(22(24)25)7-15(16)18(23)27-8-12-10-28-17(21-12)9-26-14-4-1-11(20)2-5-14/h1-7,10H,8-9H2