3-(3-chloranyl-4-methoxy-phenyl)-N-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(3-chloranyl-4-methoxy-phenyl)-N-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-(3-chloro-4-methoxy-phenyl)-N-(2-morpholino-2-oxo-ethyl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(3-chloro-4-methoxyphenyl)-N-[2-(4-morpholinyl)-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(3-chloro-4-methoxyphenyl)-N-(2-morpholin-4-yl-2-oxoethyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-(3-chloro-4-methoxy-phenyl)-4-keto-N-(2-keto-2-morpholino-ethyl)phthalazine-1-carboxamide Formula: C22H21ClN4O5 MolecularWeight: 456.87894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC(=O)N4CCOCC4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC(=O)N4CCOCC4)Cl

InChI

InChI=1S/C22H21ClN4O5/c1-31-18-7-6-14(12-17(18)23)27-22(30)16-5-3-2-4-15(16)20(25-27)21(29)24-13-19(28)26-8-10-32-11-9-26/h2-7,12H,8-11,13H2,1H3,(H,24,29)