5-phenyl-1-(4-propan-2-ylphenyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: 5-phenyl-1-(4-propan-2-ylphenyl)-1,2,3-triazole-4-carboxylate Openeye Name: 1-(4-isopropylphenyl)-5-phenyl-triazole-4-carboxylate CAS Name: 5-phenyl-1-(4-propan-2-ylphenyl)-4-triazolecarboxylate IUPAC Name: 5-phenyl-1-(4-propan-2-ylphenyl)triazole-4-carboxylate Traditional Name: 1-p-cumenyl-5-phenyl-triazole-4-carboxylate Formula: C18H16N3O2- MolecularWeight: 306.33854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=C(N=N2)C(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=C(N=N2)C(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H17N3O2/c1-12(2)13-8-10-15(11-9-13)21-17(14-6-4-3-5-7-14)16(18(22)23)19-20-21/h3-12H,1-2H3,(H,22,23)/p-1