N-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: N-[[4-(difluoromethoxy)-3-methoxy-phenyl]methyl]-3-isopropyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: N-[4-(difluoromethoxy)-3-methoxy-benzyl]-3-isopropyl-4-keto-phthalazine-1-carboxamide Formula: C21H21F2N3O4 MolecularWeight: 417.405946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC(=C(C=C3)OC(F)F)OC

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC(=C(C=C3)OC(F)F)OC

InChI

InChI=1S/C21H21F2N3O4/c1-12(2)26-20(28)15-7-5-4-6-14(15)18(25-26)19(27)24-11-13-8-9-16(30-21(22)23)17(10-13)29-3/h4-10,12,21H,11H2,1-3H3,(H,24,27)