N-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[[4-(difluoromethoxy)-3-methoxy-phenyl]methyl]-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-[4-(difluoromethoxy)-3-methoxy-benzyl]-4-keto-phthalazine-1-carboxamide Formula: C23H25F2N3O4 MolecularWeight: 445.459106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC(=C(C=C3)OC(F)F)OC

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC(=C(C=C3)OC(F)F)OC

InChI

InChI=1S/C23H25F2N3O4/c1-3-4-7-12-28-22(30)17-9-6-5-8-16(17)20(27-28)21(29)26-14-15-10-11-18(32-23(24)25)19(13-15)31-2/h5-6,8-11,13,23H,3-4,7,12,14H2,1-2H3,(H,26,29)