[2-[ethanoyl-(2-fluorophenyl)amino]-1,3-thiazol-4-yl]methyl 5-ethoxy-4-methoxy-2-nitro-benzoate

Systemtic Name: [2-[ethanoyl-(2-fluorophenyl)amino]-1,3-thiazol-4-yl]methyl 5-ethoxy-4-methoxy-2-nitro-benzoate Openeye Name: [2-(N-acetyl-2-fluoro-anilino)thiazol-4-yl]methyl 5-ethoxy-4-methoxy-2-nitro-benzoate CAS Name: 5-ethoxy-4-methoxy-2-nitrobenzoic acid [2-(N-acetyl-2-fluoroanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-2-fluoroanilino)-1,3-thiazol-4-yl]methyl 5-ethoxy-4-methoxy-2-nitrobenzoate Traditional Name: 5-ethoxy-4-methoxy-2-nitro-benzoic acid [2-(N-acetyl-2-fluoro-anilino)thiazol-4-yl]methyl ester Formula: C22H20FN3O7S MolecularWeight: 489.473503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)OCC2=CSC(=N2)N(C3=CC=CC=C3F)C(=O)C)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)OCC2=CSC(=N2)N(C3=CC=CC=C3F)C(=O)C)[N+](=O)[O-])OC

InChI

InChI=1S/C22H20FN3O7S/c1-4-32-20-9-15(18(26(29)30)10-19(20)31-3)21(28)33-11-14-12-34-22(24-14)25(13(2)27)17-8-6-5-7-16(17)23/h5-10,12H,4,11H2,1-3H3