2-[(3-chloranyl-4-methoxy-phenyl)methylamino]-1-phthalazin-1-yl-6-(1,2,3-triazol-1-yl)piperidin-4-ol

Systemtic Name: 2-[(3-chloranyl-4-methoxy-phenyl)methylamino]-1-phthalazin-1-yl-6-(1,2,3-triazol-1-yl)piperidin-4-ol Openeye Name: 2-[(3-chloro-4-methoxy-phenyl)methylamino]-1-phthalazin-1-yl-6-(triazol-1-yl)piperidin-4-ol CAS Name: 2-[(3-chloro-4-methoxyphenyl)methylamino]-1-(1-phthalazinyl)-6-(1-triazolyl)-4-piperidinol IUPAC Name: 2-[(3-chloro-4-methoxyphenyl)methylamino]-1-phthalazin-1-yl-6-(triazol-1-yl)piperidin-4-ol Traditional Name: 2-[(3-chloro-4-methoxy-benzyl)amino]-1-phthalazin-1-yl-6-(triazol-1-yl)piperidin-4-ol Formula: C23H24ClN7O2 MolecularWeight: 465.93536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2CC(CC(N2C3=NN=CC4=CC=CC=C43)N5C=CN=N5)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2CC(CC(N2C3=NN=CC4=CC=CC=C43)N5C=CN=N5)O)Cl

InChI

InChI=1S/C23H24ClN7O2/c1-33-20-7-6-15(10-19(20)24)13-25-21-11-17(32)12-22(30-9-8-26-29-30)31(21)23-18-5-3-2-4-16(18)14-27-28-23/h2-10,14,17,21-22,25,32H,11-13H2,1H3