(2-chloranyl-5-methyl-phenyl) 3-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: (2-chloranyl-5-methyl-phenyl) 3-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: (2-chloro-5-methyl-phenyl) 3-(tetrazol-1-yl)benzoate CAS Name: 3-(1-tetrazolyl)benzoic acid (2-chloro-5-methylphenyl) ester IUPAC Name: (2-chloro-5-methylphenyl) 3-(tetrazol-1-yl)benzoate Traditional Name: 3-(tetrazol-1-yl)benzoic acid (2-chloro-5-methyl-phenyl) ester Formula: C15H11ClN4O2 MolecularWeight: 314.72644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OC(=O)C2=CC(=CC=C2)N3C=NN=N3

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OC(=O)C2=CC(=CC=C2)N3C=NN=N3

InChI

InChI=1S/C15H11ClN4O2/c1-10-5-6-13(16)14(7-10)22-15(21)11-3-2-4-12(8-11)20-9-17-18-19-20/h2-9H,1H3