1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 4-oxidanylidene-3H-phthalazine-1-carboxylate

Systemtic Name: 1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 4-oxidanylidene-3H-phthalazine-1-carboxylate Openeye Name: 1-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]ethyl 4-oxo-3H-phthalazine-1-carboxylate CAS Name: 4-oxo-3H-phthalazine-1-carboxylic acid 1-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl ester IUPAC Name: 1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 4-oxo-3H-phthalazine-1-carboxylate Traditional Name: 4-keto-3H-phthalazine-1-carboxylic acid 1-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]ethyl ester Formula: C18H13N5O4 MolecularWeight: 363.32692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NO1)C2=CN=CC=C2)OC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CC(C1=NC(=NO1)C2=CN=CC=C2)OC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C18H13N5O4/c1-10(17-20-15(23-27-17)11-5-4-8-19-9-11)26-18(25)14-12-6-2-3-7-13(12)16(24)22-21-14/h2-10H,1H3,(H,22,24)