ethyl 1-[(E)-(3-fluorophenyl)methylideneamino]-5-phenacyloxy-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 1-[(E)-(3-fluorophenyl)methylideneamino]-5-phenacyloxy-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-[(E)-(3-fluorophenyl)methyleneamino]-5-phenacyloxy-triazole-4-carboxylate CAS Name: 1-[(E)-(3-fluorophenyl)methylideneamino]-5-phenacyloxy-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(E)-(3-fluorophenyl)methylideneamino]-5-phenacyloxytriazole-4-carboxylate Traditional Name: 1-[(E)-(3-fluorobenzylidene)amino]-5-phenacyloxy-triazole-4-carboxylic acid ethyl ester Formula: C20H17FN4O4 MolecularWeight: 396.371783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)N=CC2=CC(=CC=C2)F)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)/N=C/C2=CC(=CC=C2)F)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H17FN4O4/c1-2-28-20(27)18-19(29-13-17(26)15-8-4-3-5-9-15)25(24-23-18)22-12-14-7-6-10-16(21)11-14/h3-12H,2,13H2,1H3/b22-12+