[4-[6-(4-acetyloxyphenyl)-1,2,4,5-tetrazin-3-yl]phenyl] ethanoate

Systemtic Name: [4-[6-(4-acetyloxyphenyl)-1,2,4,5-tetrazin-3-yl]phenyl] ethanoate Openeye Name: [4-[6-(4-acetoxyphenyl)-1,2,4,5-tetrazin-3-yl]phenyl] acetate CAS Name: acetic acid [4-[6-(4-acetyloxyphenyl)-1,2,4,5-tetrazin-3-yl]phenyl] ester IUPAC Name: [4-[6-(4-acetyloxyphenyl)-1,2,4,5-tetrazin-3-yl]phenyl] acetate Traditional Name: acetic acid [4-[6-(4-acetoxyphenyl)-1,2,4,5-tetrazin-3-yl]phenyl] ester Formula: C18H14N4O4 MolecularWeight: 350.32816

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2=NN=C(N=N2)C3=CC=C(C=C3)OC(=O)C

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2=NN=C(N=N2)C3=CC=C(C=C3)OC(=O)C

InChI

InChI=1S/C18H14N4O4/c1-11(23)25-15-7-3-13(4-8-15)17-19-21-18(22-20-17)14-5-9-16(10-6-14)26-12(2)24/h3-10H,1-2H3