5-(3-tert-butyl-4-methoxy-phenyl)-2H-1,2,3,4-tetrazole

Systemtic Name: 5-(3-tert-butyl-4-methoxy-phenyl)-2H-1,2,3,4-tetrazole Openeye Name: 5-(3-tert-butyl-4-methoxy-phenyl)-2H-tetrazole CAS Name: 5-(3-tert-butyl-4-methoxyphenyl)-2H-tetrazole IUPAC Name: 5-(3-tert-butyl-4-methoxyphenyl)-2H-tetrazole Traditional Name: 5-(3-tert-butyl-4-methoxy-phenyl)-2H-tetrazole Formula: C12H16N4O MolecularWeight: 232.28164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)C2=NNN=N2)OC

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)C2=NNN=N2)OC

InChI

InChI=1S/C12H16N4O/c1-12(2,3)9-7-8(5-6-10(9)17-4)11-13-15-16-14-11/h5-7H,1-4H3,(H,13,14,15,16)