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

Systemtic Name: [1-[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]phthalazin-1-yl]-4-methoxy-piperidin-4-yl]methanol Openeye Name: [1-[4-[(3-chloro-4-methoxy-phenyl)methylamino]phthalazin-1-yl]-4-methoxy-4-piperidyl]methanol CAS Name: [1-[4-[(3-chloro-4-methoxyphenyl)methylamino]-1-phthalazinyl]-4-methoxy-4-piperidinyl]methanol IUPAC Name: [1-[4-[(3-chloro-4-methoxyphenyl)methylamino]phthalazin-1-yl]-4-methoxypiperidin-4-yl]methanol Traditional Name: [1-[4-[(3-chloro-4-methoxy-benzyl)amino]phthalazin-1-yl]-4-methoxy-4-piperidyl]methanol Formula: C23H27ClN4O3 MolecularWeight: 442.93848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27ClN4O3/c1-30-20-8-7-16(13-19(20)24)14-25-21-17-5-3-4-6-18(17)22(27-26-21)28-11-9-23(15-29,31-2)10-12-28/h3-8,13,29H,9-12,14-15H2,1-2H3,(H,25,26)