[2-[5-(azidomethyl)-2H-1,2,3-triazol-4-yl]-5-chloranyl-phenyl]-phenyl-methanone

Systemtic Name: [2-[5-(azidomethyl)-2H-1,2,3-triazol-4-yl]-5-chloranyl-phenyl]-phenyl-methanone Openeye Name: [2-[5-(azidomethyl)-2H-triazol-4-yl]-5-chloro-phenyl]-phenyl-methanone CAS Name: [2-[5-(azidomethyl)-2H-triazol-4-yl]-5-chlorophenyl]-phenylmethanone IUPAC Name: [2-[5-(azidomethyl)-2H-triazol-4-yl]-5-chlorophenyl]-phenylmethanone Traditional Name: [2-[5-(azidomethyl)-2H-triazol-4-yl]-5-chloro-phenyl]-phenyl-methanone Formula: C16H11ClN6O MolecularWeight: 338.75114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)C3=NNN=C3CN=[N+]=[N-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)C3=NNN=C3CN=[N+]=[N-]

InChI

InChI=1S/C16H11ClN6O/c17-11-6-7-12(15-14(9-19-22-18)20-23-21-15)13(8-11)16(24)10-4-2-1-3-5-10/h1-8H,9H2,(H,20,21,23)