methyl 2-[5-(4-butoxyphenyl)-1,2,3,4-tetrazol-2-yl]-2-methyl-propanoate

Systemtic Name: methyl 2-[5-(4-butoxyphenyl)-1,2,3,4-tetrazol-2-yl]-2-methyl-propanoate Openeye Name: methyl 2-[5-(4-butoxyphenyl)tetrazol-2-yl]-2-methyl-propanoate CAS Name: 2-[5-(4-butoxyphenyl)-2-tetrazolyl]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-[5-(4-butoxyphenyl)tetrazol-2-yl]-2-methylpropanoate Traditional Name: 2-[5-(4-butoxyphenyl)tetrazol-2-yl]-2-methyl-propionic acid methyl ester Formula: C16H22N4O3 MolecularWeight: 318.37088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NN(N=N2)C(C)(C)C(=O)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NN(N=N2)C(C)(C)C(=O)OC

InChI

InChI=1S/C16H22N4O3/c1-5-6-11-23-13-9-7-12(8-10-13)14-17-19-20(18-14)16(2,3)15(21)22-4/h7-10H,5-6,11H2,1-4H3