2-(3,5-dimethoxyphenyl)-4-pyrrolidin-1-ylcarbonyl-phthalazin-1-one

Systemtic Name: 2-(3,5-dimethoxyphenyl)-4-pyrrolidin-1-ylcarbonyl-phthalazin-1-one Openeye Name: 2-(3,5-dimethoxyphenyl)-4-(pyrrolidine-1-carbonyl)phthalazin-1-one CAS Name: 2-(3,5-dimethoxyphenyl)-4-[oxo(1-pyrrolidinyl)methyl]-1-phthalazinone IUPAC Name: 2-(3,5-dimethoxyphenyl)-4-(pyrrolidine-1-carbonyl)phthalazin-1-one Traditional Name: 2-(3,5-dimethoxyphenyl)-4-(pyrrolidine-1-carbonyl)phthalazin-1-one Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)N4CCCC4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)N4CCCC4)OC

InChI

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