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

Systemtic Name: 4-(4-chlorophenyl)-2-(3-oxidanylidene-3-piperidin-1-yl-propyl)phthalazin-1-one Openeye Name: 4-(4-chlorophenyl)-2-[3-oxo-3-(1-piperidyl)propyl]phthalazin-1-one CAS Name: 4-(4-chlorophenyl)-2-[3-oxo-3-(1-piperidinyl)propyl]-1-phthalazinone IUPAC Name: 4-(4-chlorophenyl)-2-(3-oxo-3-piperidin-1-ylpropyl)phthalazin-1-one Traditional Name: 4-(4-chlorophenyl)-2-(3-keto-3-piperidino-propyl)phthalazin-1-one Formula: C22H22ClN3O2 MolecularWeight: 395.88198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CCN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(CC1)C(=O)CCN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN3O2/c23-17-10-8-16(9-11-17)21-18-6-2-3-7-19(18)22(28)26(24-21)15-12-20(27)25-13-4-1-5-14-25/h2-3,6-11H,1,4-5,12-15H2