4-[5-(4-chloranyl-3-methyl-phenoxy)-1,2,3,4-tetrazol-1-yl]benzoate

Systemtic Name: 4-[5-(4-chloranyl-3-methyl-phenoxy)-1,2,3,4-tetrazol-1-yl]benzoate Openeye Name: 4-[5-(4-chloro-3-methyl-phenoxy)tetrazol-1-yl]benzoate CAS Name: 4-[5-(4-chloro-3-methylphenoxy)-1-tetrazolyl]benzoate IUPAC Name: 4-[5-(4-chloro-3-methylphenoxy)tetrazol-1-yl]benzoate Traditional Name: 4-[5-(4-chloro-3-methyl-phenoxy)tetrazol-1-yl]benzoate Formula: C15H10ClN4O3- MolecularWeight: 329.7179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=NN=NN2C3=CC=C(C=C3)C(=O)[O-])Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=NN=NN2C3=CC=C(C=C3)C(=O)[O-])Cl

InChI

InChI=1S/C15H11ClN4O3/c1-9-8-12(6-7-13(9)16)23-15-17-18-19-20(15)11-4-2-10(3-5-11)14(21)22/h2-8H,1H3,(H,21,22)/p-1