N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]phthalazine-1-carboxamide Formula: C26H22F3N3O4 MolecularWeight: 497.46579

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C26H22F3N3O4/c1-35-13-14-36-22-12-11-18(26(27,28)29)15-21(22)30-24(33)23-19-9-5-6-10-20(19)25(34)32(31-23)16-17-7-3-2-4-8-17/h2-12,15H,13-14,16H2,1H3,(H,30,33)