N-bromanyl-2-(3-iodanylpiperazin-1-yl)-2-(4-methylphenyl)ethanamine

Systemtic Name: N-bromanyl-2-(3-iodanylpiperazin-1-yl)-2-(4-methylphenyl)ethanamine Openeye Name: N-bromo-2-(3-iodopiperazin-1-yl)-2-(p-tolyl)ethanamine CAS Name: N-bromo-2-(3-iodo-1-piperazinyl)-2-(4-methylphenyl)ethanamine IUPAC Name: N-bromo-2-(3-iodopiperazin-1-yl)-2-(4-methylphenyl)ethanamine Traditional Name: bromo-[2-(3-iodopiperazino)-2-(p-tolyl)ethyl]amine Formula: C13H19BrIN3 MolecularWeight: 424.11853

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNBr)N2CCNC(C2)I

Isomeric SMILES

CC1=CC=C(C=C1)C(CNBr)N2CCNC(C2)I

InChI

InChI=1S/C13H19BrIN3/c1-10-2-4-11(5-3-10)12(8-17-14)18-7-6-16-13(15)9-18/h2-5,12-13,16-17H,6-9H2,1H3