3-(3-chloranyl-4-methoxy-phenyl)-4-oxidanylidene-N-[2-oxidanylidene-2-(pyridin-2-ylamino)ethyl]phthalazine-1-carboxamide

Systemtic Name: 3-(3-chloranyl-4-methoxy-phenyl)-4-oxidanylidene-N-[2-oxidanylidene-2-(pyridin-2-ylamino)ethyl]phthalazine-1-carboxamide Openeye Name: 3-(3-chloro-4-methoxy-phenyl)-4-oxo-N-[2-oxo-2-(2-pyridylamino)ethyl]phthalazine-1-carboxamide CAS Name: 3-(3-chloro-4-methoxyphenyl)-4-oxo-N-[2-oxo-2-(2-pyridinylamino)ethyl]-1-phthalazinecarboxamide IUPAC Name: 3-(3-chloro-4-methoxyphenyl)-4-oxo-N-[2-oxo-2-(pyridin-2-ylamino)ethyl]phthalazine-1-carboxamide Traditional Name: 3-(3-chloro-4-methoxy-phenyl)-4-keto-N-[2-keto-2-(2-pyridylamino)ethyl]phthalazine-1-carboxamide Formula: C23H18ClN5O4 MolecularWeight: 463.87312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC(=O)NC4=CC=CC=N4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC(=O)NC4=CC=CC=N4)Cl

InChI

InChI=1S/C23H18ClN5O4/c1-33-18-10-9-14(12-17(18)24)29-23(32)16-7-3-2-6-15(16)21(28-29)22(31)26-13-20(30)27-19-8-4-5-11-25-19/h2-12H,13H2,1H3,(H,26,31)(H,25,27,30)