4-[2-oxidanylidene-2-[4-(quinolin-8-ylmethyl)piperazin-1-yl]ethyl]-2H-phthalazin-1-one

Systemtic Name: 4-[2-oxidanylidene-2-[4-(quinolin-8-ylmethyl)piperazin-1-yl]ethyl]-2H-phthalazin-1-one Openeye Name: 4-[2-oxo-2-[4-(8-quinolylmethyl)piperazin-1-yl]ethyl]-2H-phthalazin-1-one CAS Name: 4-[2-oxo-2-[4-(8-quinolinylmethyl)-1-piperazinyl]ethyl]-2H-phthalazin-1-one IUPAC Name: 4-[2-oxo-2-[4-(quinolin-8-ylmethyl)piperazin-1-yl]ethyl]-2H-phthalazin-1-one Traditional Name: 4-[2-keto-2-[4-(8-quinolylmethyl)piperazino]ethyl]-2H-phthalazin-1-one Formula: C24H23N5O2 MolecularWeight: 413.47172

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC3=C2N=CC=C3)C(=O)CC4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CC2=CC=CC3=C2N=CC=C3)C(=O)CC4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C24H23N5O2/c30-22(15-21-19-8-1-2-9-20(19)24(31)27-26-21)29-13-11-28(12-14-29)16-18-6-3-5-17-7-4-10-25-23(17)18/h1-10H,11-16H2,(H,27,31)