4-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]carbonyl-2H-phthalazin-1-one

Systemtic Name: 4-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]carbonyl-2H-phthalazin-1-one Openeye Name: 4-[2-(2,5-dimethoxyphenyl)pyrrolidine-1-carbonyl]-2H-phthalazin-1-one CAS Name: 4-[[2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]-oxomethyl]-2H-phthalazin-1-one IUPAC Name: 4-[2-(2,5-dimethoxyphenyl)pyrrolidine-1-carbonyl]-2H-phthalazin-1-one Traditional Name: 4-[2-(2,5-dimethoxyphenyl)pyrrolidine-1-carbonyl]-2H-phthalazin-1-one Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H21N3O4/c1-27-13-9-10-18(28-2)16(12-13)17-8-5-11-24(17)21(26)19-14-6-3-4-7-15(14)20(25)23-22-19/h3-4,6-7,9-10,12,17H,5,8,11H2,1-2H3,(H,23,25)