ethyl 4-[2-[1-(5-chloranyl-3H-phthalazin-2-yl)piperidin-4-yl]ethoxy]benzoate

Systemtic Name: ethyl 4-[2-[1-(5-chloranyl-3H-phthalazin-2-yl)piperidin-4-yl]ethoxy]benzoate Openeye Name: ethyl 4-[2-[1-(5-chloro-3H-phthalazin-2-yl)-4-piperidyl]ethoxy]benzoate CAS Name: 4-[2-[1-(5-chloro-3H-phthalazin-2-yl)-4-piperidinyl]ethoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[1-(5-chloro-3H-phthalazin-2-yl)piperidin-4-yl]ethoxy]benzoate Traditional Name: 4-[2-[1-(5-chloro-3H-phthalazin-2-yl)-4-piperidyl]ethoxy]benzoic acid ethyl ester Formula: C24H28ClN3O3 MolecularWeight: 441.95042

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCCC2CCN(CC2)N3C=C4C=CC=C(C4=CN3)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCCC2CCN(CC2)N3C=C4C=CC=C(C4=CN3)Cl

InChI

InChI=1S/C24H28ClN3O3/c1-2-30-24(29)19-6-8-21(9-7-19)31-15-12-18-10-13-27(14-11-18)28-17-20-4-3-5-23(25)22(20)16-26-28/h3-9,16-18,26H,2,10-15H2,1H3