pentyl 6-phenyl-5H-pyrazolo[5,1-c][1,2,4]triazole-7-carboxylate

Systemtic Name: pentyl 6-phenyl-5H-pyrazolo[5,1-c][1,2,4]triazole-7-carboxylate Openeye Name: pentyl 6-phenyl-5H-pyrazolo[5,1-c][1,2,4]triazole-7-carboxylate CAS Name: 6-phenyl-5H-pyrazolo[5,1-c][1,2,4]triazole-7-carboxylic acid pentyl ester IUPAC Name: pentyl 6-phenyl-5H-pyrazolo[5,1-c][1,2,4]triazole-7-carboxylate Traditional Name: 6-phenyl-5H-pyrazolo[5,1-c][1,2,4]triazole-7-carboxylic acid amyl ester Formula: C16H18N4O2 MolecularWeight: 298.33972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(NN2C1=NN=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCOC(=O)C1=C(NN2C1=NN=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H18N4O2/c1-2-3-7-10-22-16(21)13-14(12-8-5-4-6-9-12)19-20-11-17-18-15(13)20/h4-6,8-9,11,19H,2-3,7,10H2,1H3