1-(4-azido-3-iodanyl-phenyl)-2-[4-(2,4-dimethylphenyl)piperazin-1-yl]ethanone

Systemtic Name: 1-(4-azido-3-iodanyl-phenyl)-2-[4-(2,4-dimethylphenyl)piperazin-1-yl]ethanone Openeye Name: 1-(4-azido-3-iodo-phenyl)-2-[4-(2,4-dimethylphenyl)piperazin-1-yl]ethanone CAS Name: 1-(4-azido-3-iodophenyl)-2-[4-(2,4-dimethylphenyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-azido-3-iodophenyl)-2-[4-(2,4-dimethylphenyl)piperazin-1-yl]ethanone Traditional Name: 1-(4-azido-3-iodo-phenyl)-2-[4-(2,4-dimethylphenyl)piperazino]ethanone Formula: C20H22IN5O MolecularWeight: 475.32605

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CCN(CC2)CC(=O)C3=CC(=C(C=C3)N=[N+]=[N-])I)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2CCN(CC2)CC(=O)C3=CC(=C(C=C3)N=[N+]=[N-])I)C

InChI

InChI=1S/C20H22IN5O/c1-14-3-6-19(15(2)11-14)26-9-7-25(8-10-26)13-20(27)16-4-5-18(23-24-22)17(21)12-16/h3-6,11-12H,7-10,13H2,1-2H3