[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate

Systemtic Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate Openeye Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-(4-oxo-3H-phthalazin-1-yl)acetate CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)acetic acid [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-(4-oxo-3H-phthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)acetic acid [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C21H18N4O4 MolecularWeight: 390.39202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H18N4O4/c1-2-13-7-9-14(10-8-13)20-22-18(29-25-20)12-28-19(26)11-17-15-5-3-4-6-16(15)21(27)24-23-17/h3-10H,2,11-12H2,1H3,(H,24,27)