4-(4-chlorophenyl)-2-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)phthalazin-1-one

Systemtic Name: 4-(4-chlorophenyl)-2-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)phthalazin-1-one Openeye Name: 4-(4-chlorophenyl)-2-(3-oxo-3-pyrrolidin-1-yl-propyl)phthalazin-1-one CAS Name: 4-(4-chlorophenyl)-2-[3-oxo-3-(1-pyrrolidinyl)propyl]-1-phthalazinone IUPAC Name: 4-(4-chlorophenyl)-2-(3-oxo-3-pyrrolidin-1-ylpropyl)phthalazin-1-one Traditional Name: 4-(4-chlorophenyl)-2-(3-keto-3-pyrrolidino-propyl)phthalazin-1-one Formula: C21H20ClN3O2 MolecularWeight: 381.8554

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(C1)C(=O)CCN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H20ClN3O2/c22-16-9-7-15(8-10-16)20-17-5-1-2-6-18(17)21(27)25(23-20)14-11-19(26)24-12-3-4-13-24/h1-2,5-10H,3-4,11-14H2