1-[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]phthalazin-1-yl]piperidin-4-one

Systemtic Name: 1-[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]phthalazin-1-yl]piperidin-4-one Openeye Name: 1-[4-[(3-chloro-4-methoxy-phenyl)methylamino]phthalazin-1-yl]piperidin-4-one CAS Name: 1-[4-[(3-chloro-4-methoxyphenyl)methylamino]-1-phthalazinyl]-4-piperidinone IUPAC Name: 1-[4-[(3-chloro-4-methoxyphenyl)methylamino]phthalazin-1-yl]piperidin-4-one Traditional Name: 1-[4-[(3-chloro-4-methoxy-benzyl)amino]phthalazin-1-yl]-4-piperidone Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NN=C(C3=CC=CC=C32)N4CCC(=O)CC4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NN=C(C3=CC=CC=C32)N4CCC(=O)CC4)Cl

InChI

InChI=1S/C21H21ClN4O2/c1-28-19-7-6-14(12-18(19)22)13-23-20-16-4-2-3-5-17(16)21(25-24-20)26-10-8-15(27)9-11-26/h2-7,12H,8-11,13H2,1H3,(H,23,24)