[4-(5-cyano-2H-1,2,3-triazol-4-yl)phenyl] 4-chloranylbenzoate

Systemtic Name: [4-(5-cyano-2H-1,2,3-triazol-4-yl)phenyl] 4-chloranylbenzoate Openeye Name: [4-(5-cyano-2H-triazol-4-yl)phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [4-(5-cyano-2H-triazol-4-yl)phenyl] ester IUPAC Name: [4-(5-cyano-2H-triazol-4-yl)phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [4-(5-cyano-2H-triazol-4-yl)phenyl] ester Formula: C16H9ClN4O2 MolecularWeight: 324.72126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NNN=C2C#N)OC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NNN=C2C#N)OC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H9ClN4O2/c17-12-5-1-11(2-6-12)16(22)23-13-7-3-10(4-8-13)15-14(9-18)19-21-20-15/h1-8H,(H,19,20,21)