4-[3-azanyl-4-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]-2H-phthalazin-1-one

Systemtic Name: 4-[3-azanyl-4-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]-2H-phthalazin-1-one Openeye Name: 4-[3-amino-4-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]-2H-phthalazin-1-one CAS Name: 4-[3-amino-4-[4-(2-hydroxyethyl)-1-piperazinyl]phenyl]-2H-phthalazin-1-one IUPAC Name: 4-[3-amino-4-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]-2H-phthalazin-1-one Traditional Name: 4-[3-amino-4-[4-(2-hydroxyethyl)piperazino]phenyl]-2H-phthalazin-1-one Formula: C20H23N5O2 MolecularWeight: 365.42892

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=C(C=C(C=C2)C3=NNC(=O)C4=CC=CC=C43)N

Isomeric SMILES

C1CN(CCN1CCO)C2=C(C=C(C=C2)C3=NNC(=O)C4=CC=CC=C43)N

InChI

InChI=1S/C20H23N5O2/c21-17-13-14(19-15-3-1-2-4-16(15)20(27)23-22-19)5-6-18(17)25-9-7-24(8-10-25)11-12-26/h1-6,13,26H,7-12,21H2,(H,23,27)