1-[[4-(azidomethyl)phenyl]methyl]-N-(phenylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[[4-(azidomethyl)phenyl]methyl]-N-(phenylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-[[4-(azidomethyl)phenyl]methyl]-N-benzyl-triazole-4-carboxamide CAS Name: 1-[[4-(azidomethyl)phenyl]methyl]-N-(phenylmethyl)-4-triazolecarboxamide IUPAC Name: 1-[[4-(azidomethyl)phenyl]methyl]-N-benzyltriazole-4-carboxamide Traditional Name: 1-[4-(azidomethyl)benzyl]-N-benzyl-triazole-4-carboxamide Formula: C18H17N7O MolecularWeight: 347.37388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CN(N=N2)CC3=CC=C(C=C3)CN=[N+]=[N-]

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CN(N=N2)CC3=CC=C(C=C3)CN=[N+]=[N-]

InChI

InChI=1S/C18H17N7O/c19-23-21-11-15-6-8-16(9-7-15)12-25-13-17(22-24-25)18(26)20-10-14-4-2-1-3-5-14/h1-9,13H,10-12H2,(H,20,26)