4-chloranyl-6-[[3-[(4-methylpiperidin-1-yl)methyl]phenyl]methylamino]-2H-phthalazin-1-one

Systemtic Name: 4-chloranyl-6-[[3-[(4-methylpiperidin-1-yl)methyl]phenyl]methylamino]-2H-phthalazin-1-one Openeye Name: 4-chloro-6-[[3-[(4-methyl-1-piperidyl)methyl]phenyl]methylamino]-2H-phthalazin-1-one CAS Name: 4-chloro-6-[[3-[(4-methyl-1-piperidinyl)methyl]phenyl]methylamino]-2H-phthalazin-1-one IUPAC Name: 4-chloro-6-[[3-[(4-methylpiperidin-1-yl)methyl]phenyl]methylamino]-2H-phthalazin-1-one Traditional Name: 4-chloro-6-[[3-[(4-methylpiperidino)methyl]benzyl]amino]-2H-phthalazin-1-one Formula: C22H25ClN4O MolecularWeight: 396.9131

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC2=CC(=CC=C2)CNC3=CC4=C(C=C3)C(=O)NN=C4Cl

Isomeric SMILES

CC1CCN(CC1)CC2=CC(=CC=C2)CNC3=CC4=C(C=C3)C(=O)NN=C4Cl

InChI

InChI=1S/C22H25ClN4O/c1-15-7-9-27(10-8-15)14-17-4-2-3-16(11-17)13-24-18-5-6-19-20(12-18)21(23)25-26-22(19)28/h2-6,11-12,15,24H,7-10,13-14H2,1H3,(H,26,28)