4-[2-(3-methoxyphenyl)pyrrolidin-1-yl]carbonyl-2-phenyl-phthalazin-1-one

Systemtic Name: 4-[2-(3-methoxyphenyl)pyrrolidin-1-yl]carbonyl-2-phenyl-phthalazin-1-one Openeye Name: 4-[2-(3-methoxyphenyl)pyrrolidine-1-carbonyl]-2-phenyl-phthalazin-1-one CAS Name: 4-[[2-(3-methoxyphenyl)-1-pyrrolidinyl]-oxomethyl]-2-phenyl-1-phthalazinone IUPAC Name: 4-[2-(3-methoxyphenyl)pyrrolidine-1-carbonyl]-2-phenylphthalazin-1-one Traditional Name: 4-[2-(3-methoxyphenyl)pyrrolidine-1-carbonyl]-2-phenyl-phthalazin-1-one Formula: C26H23N3O3 MolecularWeight: 425.47912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2CCCN2C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)C2CCCN2C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C26H23N3O3/c1-32-20-12-7-9-18(17-20)23-15-8-16-28(23)26(31)24-21-13-5-6-14-22(21)25(30)29(27-24)19-10-3-2-4-11-19/h2-7,9-14,17,23H,8,15-16H2,1H3