(3-bromophenyl)methyl-(1-ethylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (3-bromophenyl)methyl-(1-ethylpiperidin-1-ium-4-yl)azanium Openeye Name: (3-bromophenyl)methyl-(1-ethylpiperidin-1-ium-4-yl)ammonium CAS Name: (3-bromophenyl)methyl-(1-ethyl-4-piperidin-1-iumyl)ammonium IUPAC Name: (3-bromophenyl)methyl-(1-ethylpiperidin-1-ium-4-yl)azanium Traditional Name: (3-bromobenzyl)-(1-ethylpiperidin-1-ium-4-yl)ammonium Formula: C14H23BrN2+2 MolecularWeight: 299.24982

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)[NH2+]CC2=CC(=CC=C2)Br

Isomeric SMILES

CC[NH+]1CCC(CC1)[NH2+]CC2=CC(=CC=C2)Br

InChI

InChI=1S/C14H21BrN2/c1-2-17-8-6-14(7-9-17)16-11-12-4-3-5-13(15)10-12/h3-5,10,14,16H,2,6-9,11H2,1H3/p+2