methyl 2-(1-phenacyl-1,2,3,4-tetrazol-5-yl)ethanoate

Systemtic Name: methyl 2-(1-phenacyl-1,2,3,4-tetrazol-5-yl)ethanoate Openeye Name: methyl 2-(1-phenacyltetrazol-5-yl)acetate CAS Name: 2-(1-phenacyl-5-tetrazolyl)acetic acid methyl ester IUPAC Name: methyl 2-(1-phenacyltetrazol-5-yl)acetate Traditional Name: 2-(1-phenacyltetrazol-5-yl)acetic acid methyl ester Formula: C12H12N4O3 MolecularWeight: 260.24868

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=NN=NN1CC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CC1=NN=NN1CC(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H12N4O3/c1-19-12(18)7-11-13-14-15-16(11)8-10(17)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3