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

Systemtic Name: methyl 2-[5-(3,4-dimethoxyphenyl)-1,2,3,4-tetrazol-2-yl]ethanoate Openeye Name: methyl 2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]acetate CAS Name: 2-[5-(3,4-dimethoxyphenyl)-2-tetrazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]acetate Traditional Name: 2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]acetic acid methyl ester Formula: C12H14N4O4 MolecularWeight: 278.26396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N4O4/c1-18-9-5-4-8(6-10(9)19-2)12-13-15-16(14-12)7-11(17)20-3/h4-6H,7H2,1-3H3