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

Systemtic Name: N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N-methyl-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[(3-fluoro-4-methoxy-phenyl)methyl]-N-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-(3-fluoro-4-methoxy-benzyl)-4-keto-N-methyl-phthalazine-1-carboxamide Formula: C25H22FN3O3 MolecularWeight: 431.458883

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)F)C(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)F)C(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C25H22FN3O3/c1-28(15-18-12-13-22(32-2)21(26)14-18)25(31)23-19-10-6-7-11-20(19)24(30)29(27-23)16-17-8-4-3-5-9-17/h3-14H,15-16H2,1-2H3