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

Systemtic Name: methyl 3-[5-(4-methylphenyl)-1,2,3,4-tetrazol-2-yl]propanoate Openeye Name: methyl 3-[5-(p-tolyl)tetrazol-2-yl]propanoate CAS Name: 3-[5-(4-methylphenyl)-2-tetrazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-(4-methylphenyl)tetrazol-2-yl]propanoate Traditional Name: 3-[5-(p-tolyl)tetrazol-2-yl]propionic acid methyl ester Formula: C12H14N4O2 MolecularWeight: 246.26516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(N=N2)CCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(N=N2)CCC(=O)OC

InChI

InChI=1S/C12H14N4O2/c1-9-3-5-10(6-4-9)12-13-15-16(14-12)8-7-11(17)18-2/h3-6H,7-8H2,1-2H3