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

Systemtic Name: 1-[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]phthalazin-1-yl]piperidin-2-ol Openeye Name: 1-[4-[(3-chloro-4-methoxy-phenyl)methylamino]phthalazin-1-yl]piperidin-2-ol CAS Name: 1-[4-[(3-chloro-4-methoxyphenyl)methylamino]-1-phthalazinyl]-2-piperidinol IUPAC Name: 1-[4-[(3-chloro-4-methoxyphenyl)methylamino]phthalazin-1-yl]piperidin-2-ol Traditional Name: 1-[4-[(3-chloro-4-methoxy-benzyl)amino]phthalazin-1-yl]piperidin-2-ol Formula: C21H23ClN4O2 MolecularWeight: 398.88592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NN=C(C3=CC=CC=C32)N4CCCCC4O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NN=C(C3=CC=CC=C32)N4CCCCC4O)Cl

InChI

InChI=1S/C21H23ClN4O2/c1-28-18-10-9-14(12-17(18)22)13-23-20-15-6-2-3-7-16(15)21(25-24-20)26-11-5-4-8-19(26)27/h2-3,6-7,9-10,12,19,27H,4-5,8,11,13H2,1H3,(H,23,24)