phenacyl 2-[5-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-2-yl]ethanoate

Systemtic Name: phenacyl 2-[5-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-2-yl]ethanoate Openeye Name: phenacyl 2-[5-(4-isopropylphenyl)tetrazol-2-yl]acetate CAS Name: 2-[5-(4-propan-2-ylphenyl)-2-tetrazolyl]acetic acid phenacyl ester IUPAC Name: phenacyl 2-[5-(4-propan-2-ylphenyl)tetrazol-2-yl]acetate Traditional Name: 2-(5-p-cumenyltetrazol-2-yl)acetic acid phenacyl ester Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N4O3/c1-14(2)15-8-10-17(11-9-15)20-21-23-24(22-20)12-19(26)27-13-18(25)16-6-4-3-5-7-16/h3-11,14H,12-13H2,1-2H3