2-oxidanylidenepropyl 2-[5-(4-methylphenyl)-1,2,3,4-tetrazol-2-yl]ethanoate

Systemtic Name: 2-oxidanylidenepropyl 2-[5-(4-methylphenyl)-1,2,3,4-tetrazol-2-yl]ethanoate Openeye Name: acetonyl 2-[5-(p-tolyl)tetrazol-2-yl]acetate CAS Name: 2-[5-(4-methylphenyl)-2-tetrazolyl]acetic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 2-[5-(4-methylphenyl)tetrazol-2-yl]acetate Traditional Name: 2-[5-(p-tolyl)tetrazol-2-yl]acetic acid acetonyl ester Formula: C13H14N4O3 MolecularWeight: 274.27526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N4O3/c1-9-3-5-11(6-4-9)13-14-16-17(15-13)7-12(19)20-8-10(2)18/h3-6H,7-8H2,1-2H3