1-[4-[(3-iodanylphenyl)methyl]piperazin-1-yl]-2,2-dimethyl-propan-1-one

Systemtic Name: 1-[4-[(3-iodanylphenyl)methyl]piperazin-1-yl]-2,2-dimethyl-propan-1-one Openeye Name: 1-[4-[(3-iodophenyl)methyl]piperazin-1-yl]-2,2-dimethyl-propan-1-one CAS Name: 1-[4-[(3-iodophenyl)methyl]-1-piperazinyl]-2,2-dimethyl-1-propanone IUPAC Name: 1-[4-[(3-iodophenyl)methyl]piperazin-1-yl]-2,2-dimethylpropan-1-one Traditional Name: 1-[4-(3-iodobenzyl)piperazino]-2,2-dimethyl-propan-1-one Formula: C16H23IN2O MolecularWeight: 386.27109

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCN(CC1)CC2=CC(=CC=C2)I

Isomeric SMILES

CC(C)(C)C(=O)N1CCN(CC1)CC2=CC(=CC=C2)I

InChI

InChI=1S/C16H23IN2O/c1-16(2,3)15(20)19-9-7-18(8-10-19)12-13-5-4-6-14(17)11-13/h4-6,11H,7-10,12H2,1-3H3