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

Systemtic Name: phenacyl 3-[5-(4-methylphenyl)-1,2,3,4-tetrazol-2-yl]propanoate Openeye Name: phenacyl 3-[5-(p-tolyl)tetrazol-2-yl]propanoate CAS Name: 3-[5-(4-methylphenyl)-2-tetrazolyl]propanoic acid phenacyl ester IUPAC Name: phenacyl 3-[5-(4-methylphenyl)tetrazol-2-yl]propanoate Traditional Name: 3-[5-(p-tolyl)tetrazol-2-yl]propionic acid phenacyl ester Formula: C19H18N4O3 MolecularWeight: 350.37122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(N=N2)CCC(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(N=N2)CCC(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H18N4O3/c1-14-7-9-16(10-8-14)19-20-22-23(21-19)12-11-18(25)26-13-17(24)15-5-3-2-4-6-15/h2-10H,11-13H2,1H3