tert-butyl 3-[4-(2-tert-butyl-1,2,3,4-tetrazol-5-yl)phenyl]propanoate

Systemtic Name: tert-butyl 3-[4-(2-tert-butyl-1,2,3,4-tetrazol-5-yl)phenyl]propanoate Openeye Name: tert-butyl 3-[4-(2-tert-butyltetrazol-5-yl)phenyl]propanoate CAS Name: 3-[4-(2-tert-butyl-5-tetrazolyl)phenyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[4-(2-tert-butyltetrazol-5-yl)phenyl]propanoate Traditional Name: 3-[4-(2-tert-butyltetrazol-5-yl)phenyl]propionic acid tert-butyl ester Formula: C18H26N4O2 MolecularWeight: 330.42464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1N=C(N=N1)C2=CC=C(C=C2)CCC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)N1N=C(N=N1)C2=CC=C(C=C2)CCC(=O)OC(C)(C)C

InChI

InChI=1S/C18H26N4O2/c1-17(2,3)22-20-16(19-21-22)14-10-7-13(8-11-14)9-12-15(23)24-18(4,5)6/h7-8,10-11H,9,12H2,1-6H3