2-[1-[(4-bromophenyl)methyl]piperidin-1-ium-4-yl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[1-[(4-bromophenyl)methyl]piperidin-1-ium-4-yl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[1-[(4-bromophenyl)methyl]piperidin-1-ium-4-yl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[1-[(4-bromophenyl)methyl]-4-piperidin-1-iumyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[1-[(4-bromophenyl)methyl]piperidin-1-ium-4-yl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[1-(4-bromobenzyl)piperidin-1-ium-4-yl]-3,4-dihydro-1H-isoquinoline Formula: C21H26BrN2+ MolecularWeight: 386.34854

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2CCC3=CC=CC=C3C2)CC4=CC=C(C=C4)Br

Isomeric SMILES

C1C[NH+](CCC1N2CCC3=CC=CC=C3C2)CC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H25BrN2/c22-20-7-5-17(6-8-20)15-23-12-10-21(11-13-23)24-14-9-18-3-1-2-4-19(18)16-24/h1-8,21H,9-16H2/p+1