(2-nitrophenyl)methyl 2-(4-fluorophenyl)-1,3-thiazole-4-carboxylate

Systemtic Name: (2-nitrophenyl)methyl 2-(4-fluorophenyl)-1,3-thiazole-4-carboxylate Openeye Name: (2-nitrophenyl)methyl 2-(4-fluorophenyl)thiazole-4-carboxylate CAS Name: 2-(4-fluorophenyl)-4-thiazolecarboxylic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 2-(4-fluorophenyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(4-fluorophenyl)thiazole-4-carboxylic acid (2-nitrobenzyl) ester Formula: C17H11FN2O4S MolecularWeight: 358.343643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)C2=CSC(=N2)C3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)C2=CSC(=N2)C3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C17H11FN2O4S/c18-13-7-5-11(6-8-13)16-19-14(10-25-16)17(21)24-9-12-3-1-2-4-15(12)20(22)23/h1-8,10H,9H2