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

Systemtic Name: ethyl 5-[(E)-dimethylaminomethylideneamino]-1-(3-fluorophenyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 5-[(E)-dimethylaminomethyleneamino]-1-(3-fluorophenyl)triazole-4-carboxylate CAS Name: 5-[(E)-dimethylaminomethylideneamino]-1-(3-fluorophenyl)-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(E)-dimethylaminomethylideneamino]-1-(3-fluorophenyl)triazole-4-carboxylate Traditional Name: 5-[(E)-dimethylaminomethyleneamino]-1-(3-fluorophenyl)triazole-4-carboxylic acid ethyl ester Formula: C14H16FN5O2 MolecularWeight: 305.307543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)C2=CC(=CC=C2)F)N=CN(C)C

Isomeric SMILES

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

InChI

InChI=1S/C14H16FN5O2/c1-4-22-14(21)12-13(16-9-19(2)3)20(18-17-12)11-7-5-6-10(15)8-11/h5-9H,4H2,1-3H3/b16-9+