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

Systemtic Name: phenacyl 2-[5-(3,4-dimethoxyphenyl)-1,2,3,4-tetrazol-2-yl]ethanoate Openeye Name: phenacyl 2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]acetate CAS Name: 2-[5-(3,4-dimethoxyphenyl)-2-tetrazolyl]acetic acid phenacyl ester IUPAC Name: phenacyl 2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]acetate Traditional Name: 2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]acetic acid phenacyl ester Formula: C19H18N4O5 MolecularWeight: 382.37002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(N=N2)CC(=O)OCC(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(N=N2)CC(=O)OCC(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C19H18N4O5/c1-26-16-9-8-14(10-17(16)27-2)19-20-22-23(21-19)11-18(25)28-12-15(24)13-6-4-3-5-7-13/h3-10H,11-12H2,1-2H3