4-[4-[[methyl(propan-2-yl)amino]methyl]piperidin-1-yl]carbonyl-2-phenyl-phthalazin-1-one

Systemtic Name: 4-[4-[[methyl(propan-2-yl)amino]methyl]piperidin-1-yl]carbonyl-2-phenyl-phthalazin-1-one Openeye Name: 4-[4-[[isopropyl(methyl)amino]methyl]piperidine-1-carbonyl]-2-phenyl-phthalazin-1-one CAS Name: 4-[[4-[[methyl(propan-2-yl)amino]methyl]-1-piperidinyl]-oxomethyl]-2-phenyl-1-phthalazinone IUPAC Name: 4-[4-[[methyl(propan-2-yl)amino]methyl]piperidine-1-carbonyl]-2-phenylphthalazin-1-one Traditional Name: 4-[4-[[isopropyl(methyl)amino]methyl]piperidine-1-carbonyl]-2-phenyl-phthalazin-1-one Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)CC1CCN(CC1)C(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC(C)N(C)CC1CCN(CC1)C(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C25H30N4O2/c1-18(2)27(3)17-19-13-15-28(16-14-19)25(31)23-21-11-7-8-12-22(21)24(30)29(26-23)20-9-5-4-6-10-20/h4-12,18-19H,13-17H2,1-3H3