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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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