1-[5-[(3-chloranyl-4-methoxy-phenyl)methylamino]-4-(fluoranylmethyl)phthalazin-1-yl]piperidin-4-ol

Systemtic Name: 1-[5-[(3-chloranyl-4-methoxy-phenyl)methylamino]-4-(fluoranylmethyl)phthalazin-1-yl]piperidin-4-ol Openeye Name: 1-[5-[(3-chloro-4-methoxy-phenyl)methylamino]-4-(fluoromethyl)phthalazin-1-yl]piperidin-4-ol CAS Name: 1-[5-[(3-chloro-4-methoxyphenyl)methylamino]-4-(fluoromethyl)-1-phthalazinyl]-4-piperidinol IUPAC Name: 1-[5-[(3-chloro-4-methoxyphenyl)methylamino]-4-(fluoromethyl)phthalazin-1-yl]piperidin-4-ol Traditional Name: 1-[5-[(3-chloro-4-methoxy-benzyl)amino]-4-(fluoromethyl)phthalazin-1-yl]piperidin-4-ol Formula: C22H24ClFN4O2 MolecularWeight: 430.902963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=CC=CC3=C2C(=NN=C3N4CCC(CC4)O)CF)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=CC=CC3=C2C(=NN=C3N4CCC(CC4)O)CF)Cl

InChI

InChI=1S/C22H24ClFN4O2/c1-30-20-6-5-14(11-17(20)23)13-25-18-4-2-3-16-21(18)19(12-24)26-27-22(16)28-9-7-15(29)8-10-28/h2-6,11,15,25,29H,7-10,12-13H2,1H3