1-[4-[2-[4-(6-chloranyl-1H-indazol-3-yl)-2-iodanyl-piperazin-1-yl]ethoxy]-3-methoxy-phenyl]ethanone

Systemtic Name: 1-[4-[2-[4-(6-chloranyl-1H-indazol-3-yl)-2-iodanyl-piperazin-1-yl]ethoxy]-3-methoxy-phenyl]ethanone Openeye Name: 1-[4-[2-[4-(6-chloro-1H-indazol-3-yl)-2-iodo-piperazin-1-yl]ethoxy]-3-methoxy-phenyl]ethanone CAS Name: 1-[4-[2-[4-(6-chloro-1H-indazol-3-yl)-2-iodo-1-piperazinyl]ethoxy]-3-methoxyphenyl]ethanone IUPAC Name: 1-[4-[2-[4-(6-chloro-1H-indazol-3-yl)-2-iodopiperazin-1-yl]ethoxy]-3-methoxyphenyl]ethanone Traditional Name: 1-[4-[2-[4-(6-chloro-1H-indazol-3-yl)-2-iodo-piperazino]ethoxy]-3-methoxy-phenyl]ethanone Formula: C22H24ClIN4O3 MolecularWeight: 554.80843

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCCN2CCN(CC2I)C3=NNC4=C3C=CC(=C4)Cl)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCCN2CCN(CC2I)C3=NNC4=C3C=CC(=C4)Cl)OC

InChI

InChI=1S/C22H24ClIN4O3/c1-14(29)15-3-6-19(20(11-15)30-2)31-10-9-27-7-8-28(13-21(27)24)22-17-5-4-16(23)12-18(17)25-26-22/h3-6,11-12,21H,7-10,13H2,1-2H3,(H,25,26)