[3-(1,2,3,4-tetrazol-1-yl)phenyl] 3-chloranyl-2-methyl-benzenesulfonate

Systemtic Name: [3-(1,2,3,4-tetrazol-1-yl)phenyl] 3-chloranyl-2-methyl-benzenesulfonate Openeye Name: [3-(tetrazol-1-yl)phenyl] 3-chloro-2-methyl-benzenesulfonate CAS Name: 3-chloro-2-methylbenzenesulfonic acid [3-(1-tetrazolyl)phenyl] ester IUPAC Name: [3-(tetrazol-1-yl)phenyl] 3-chloro-2-methylbenzenesulfonate Traditional Name: 3-chloro-2-methyl-benzenesulfonic acid [3-(tetrazol-1-yl)phenyl] ester Formula: C14H11ClN4O3S MolecularWeight: 350.78014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)S(=O)(=O)OC2=CC=CC(=C2)N3C=NN=N3

Isomeric SMILES

CC1=C(C=CC=C1Cl)S(=O)(=O)OC2=CC=CC(=C2)N3C=NN=N3

InChI

InChI=1S/C14H11ClN4O3S/c1-10-13(15)6-3-7-14(10)23(20,21)22-12-5-2-4-11(8-12)19-9-16-17-18-19/h2-9H,1H3