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

Systemtic Name: 5-phenyl-1-(phenylmethyl)-1,2,3-triazole-4-carboxylate Openeye Name: 1-benzyl-5-phenyl-triazole-4-carboxylate CAS Name: 5-phenyl-1-(phenylmethyl)-4-triazolecarboxylate IUPAC Name: 1-benzyl-5-phenyltriazole-4-carboxylate Traditional Name: 1-benzyl-5-phenyl-triazole-4-carboxylate Formula: C16H12N3O2- MolecularWeight: 278.28538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C16H13N3O2/c20-16(21)14-15(13-9-5-2-6-10-13)19(18-17-14)11-12-7-3-1-4-8-12/h1-10H,11H2,(H,20,21)/p-1