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

Systemtic Name: methyl 4-chloranyl-3-[3-(1,2,3,4-tetrazol-1-yl)phenoxy]sulfonyl-benzoate Openeye Name: methyl 4-chloro-3-[3-(tetrazol-1-yl)phenoxy]sulfonyl-benzoate CAS Name: 4-chloro-3-[3-(1-tetrazolyl)phenoxy]sulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[3-(tetrazol-1-yl)phenoxy]sulfonylbenzoate Traditional Name: 4-chloro-3-[3-(tetrazol-1-yl)phenoxy]sulfonyl-benzoic acid methyl ester Formula: C15H11ClN4O5S MolecularWeight: 394.78964

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)OC2=CC=CC(=C2)N3C=NN=N3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)OC2=CC=CC(=C2)N3C=NN=N3

InChI

InChI=1S/C15H11ClN4O5S/c1-24-15(21)10-5-6-13(16)14(7-10)26(22,23)25-12-4-2-3-11(8-12)20-9-17-18-19-20/h2-9H,1H3