4-(4-bromophenyl)-1-[(3,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-ol

Systemtic Name: 4-(4-bromophenyl)-1-[(3,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-ol Openeye Name: 4-(4-bromophenyl)-1-[(3,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-ol CAS Name: 4-(4-bromophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-4-piperidin-1-iumol IUPAC Name: 4-(4-bromophenyl)-1-[(3,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-ol Traditional Name: 4-(4-bromophenyl)-1-(3,5-dimethoxybenzyl)piperidin-1-ium-4-ol Formula: C20H25BrNO3+ MolecularWeight: 407.3214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C[NH+]2CCC(CC2)(C3=CC=C(C=C3)Br)O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C[NH+]2CCC(CC2)(C3=CC=C(C=C3)Br)O)OC

InChI

InChI=1S/C20H24BrNO3/c1-24-18-11-15(12-19(13-18)25-2)14-22-9-7-20(23,8-10-22)16-3-5-17(21)6-4-16/h3-6,11-13,23H,7-10,14H2,1-2H3/p+1