1-[4-chloranyl-6-(1-methylpiperazin-1-ium-1-yl)-5,6,7,8-tetrahydronaphthalen-1-yl]ethanone

Systemtic Name: 1-[4-chloranyl-6-(1-methylpiperazin-1-ium-1-yl)-5,6,7,8-tetrahydronaphthalen-1-yl]ethanone Openeye Name: 1-[8-chloro-2-(1-methylpiperazin-1-ium-1-yl)tetralin-5-yl]ethanone CAS Name: 1-[4-chloro-6-(1-methyl-1-piperazin-1-iumyl)-5,6,7,8-tetrahydronaphthalen-1-yl]ethanone IUPAC Name: 1-[4-chloro-6-(1-methylpiperazin-1-ium-1-yl)-5,6,7,8-tetrahydronaphthalen-1-yl]ethanone Traditional Name: 1-[8-chloro-2-(1-methylpiperazin-1-ium-1-yl)tetralin-5-yl]ethanone Formula: C17H24ClN2O+ MolecularWeight: 307.83826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C2CCC(CC2=C(C=C1)Cl)[N+]3(CCNCC3)C

Isomeric SMILES

CC(=O)C1=C2CCC(CC2=C(C=C1)Cl)[N+]3(CCNCC3)C

InChI

InChI=1S/C17H24ClN2O/c1-12(21)14-5-6-17(18)16-11-13(3-4-15(14)16)20(2)9-7-19-8-10-20/h5-6,13,19H,3-4,7-11H2,1-2H3/q+1