(3-bromophenyl)methyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium

Systemtic Name: (3-bromophenyl)methyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-[(3-bromophenyl)methyl]ammonium CAS Name: (3-bromophenyl)methyl-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-[(3-bromophenyl)methyl]azanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-(3-bromobenzyl)ammonium Formula: C19H25BrN2+2 MolecularWeight: 361.3192

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH2+]CC2=CC(=CC=C2)Br)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1[NH2+]CC2=CC(=CC=C2)Br)CC3=CC=CC=C3

InChI

InChI=1S/C19H23BrN2/c20-18-8-4-7-17(13-18)14-21-19-9-11-22(12-10-19)15-16-5-2-1-3-6-16/h1-8,13,19,21H,9-12,14-15H2/p+2