1-[(4-bromophenyl)methyl]-N-(2,5-dimethoxyphenyl)piperidin-1-ium-4-amine

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-(2,5-dimethoxyphenyl)piperidin-1-ium-4-amine Openeye Name: 1-[(4-bromophenyl)methyl]-N-(2,5-dimethoxyphenyl)piperidin-1-ium-4-amine CAS Name: 1-[(4-bromophenyl)methyl]-N-(2,5-dimethoxyphenyl)-4-piperidin-1-iumamine IUPAC Name: 1-[(4-bromophenyl)methyl]-N-(2,5-dimethoxyphenyl)piperidin-1-ium-4-amine Traditional Name: [1-(4-bromobenzyl)piperidin-1-ium-4-yl]-(2,5-dimethoxyphenyl)amine Formula: C20H26BrN2O2+ MolecularWeight: 406.33664

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC2CC[NH+](CC2)CC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC2CC[NH+](CC2)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H25BrN2O2/c1-24-18-7-8-20(25-2)19(13-18)22-17-9-11-23(12-10-17)14-15-3-5-16(21)6-4-15/h3-8,13,17,22H,9-12,14H2,1-2H3/p+1