2-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]-4-phenyl-phthalazin-1-one

Systemtic Name: 2-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]-4-phenyl-phthalazin-1-one Openeye Name: 2-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]-4-phenyl-phthalazin-1-one CAS Name: 2-[[2-(4-methoxyphenyl)-1-pyrrolidinyl]methyl]-4-phenyl-1-phthalazinone IUPAC Name: 2-[[2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]-4-phenylphthalazin-1-one Traditional Name: 2-[[2-(4-methoxyphenyl)pyrrolidino]methyl]-4-phenyl-phthalazin-1-one Formula: C26H25N3O2 MolecularWeight: 411.4956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCN2CN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCN2CN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=CC=C5

InChI

InChI=1S/C26H25N3O2/c1-31-21-15-13-19(14-16-21)24-12-7-17-28(24)18-29-26(30)23-11-6-5-10-22(23)25(27-29)20-8-3-2-4-9-20/h2-6,8-11,13-16,24H,7,12,17-18H2,1H3