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

Systemtic Name: 3-(3-chloranyl-4-methoxy-phenyl)-N-[2-[(3-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-(3-chloro-4-methoxy-phenyl)-N-[2-[(3-fluorophenyl)methylamino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(3-chloro-4-methoxyphenyl)-N-[2-[(3-fluorophenyl)methylamino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(3-chloro-4-methoxyphenyl)-N-[2-[(3-fluorophenyl)methylamino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-(3-chloro-4-methoxy-phenyl)-N-[2-[(3-fluorobenzyl)amino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C25H20ClFN4O4 MolecularWeight: 494.902103

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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)NCC4=CC(=CC=C4)F)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC(=O)NCC4=CC(=CC=C4)F)Cl

InChI

InChI=1S/C25H20ClFN4O4/c1-35-21-10-9-17(12-20(21)26)31-25(34)19-8-3-2-7-18(19)23(30-31)24(33)29-14-22(32)28-13-15-5-4-6-16(27)11-15/h2-12H,13-14H2,1H3,(H,28,32)(H,29,33)