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

Systemtic Name: 1-(3,4-dimethylphenyl)-5-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: 1-(3,4-dimethylphenyl)-5-phenyl-triazole-4-carboxylate CAS Name: 1-(3,4-dimethylphenyl)-5-phenyl-4-triazolecarboxylate IUPAC Name: 1-(3,4-dimethylphenyl)-5-phenyltriazole-4-carboxylate Traditional Name: 1-(3,4-dimethylphenyl)-5-phenyl-triazole-4-carboxylate Formula: C17H14N3O2- MolecularWeight: 292.31196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(N=N2)C(=O)[O-])C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C(N=N2)C(=O)[O-])C3=CC=CC=C3)C

InChI

InChI=1S/C17H15N3O2/c1-11-8-9-14(10-12(11)2)20-16(13-6-4-3-5-7-13)15(17(21)22)18-19-20/h3-10H,1-2H3,(H,21,22)/p-1