1-[2-(3-bromanylphenoxy)ethyl]-4-(phenylmethyl)pyridin-1-ium

Systemtic Name: 1-[2-(3-bromanylphenoxy)ethyl]-4-(phenylmethyl)pyridin-1-ium Openeye Name: 4-benzyl-1-[2-(3-bromophenoxy)ethyl]pyridin-1-ium CAS Name: 1-[2-(3-bromophenoxy)ethyl]-4-(phenylmethyl)pyridin-1-ium IUPAC Name: 4-benzyl-1-[2-(3-bromophenoxy)ethyl]pyridin-1-ium Traditional Name: 4-benzyl-1-[2-(3-bromophenoxy)ethyl]pyridin-1-ium Formula: C20H19BrNO+ MolecularWeight: 369.27496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=[N+](C=C2)CCOC3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=[N+](C=C2)CCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C20H19BrNO/c21-19-7-4-8-20(16-19)23-14-13-22-11-9-18(10-12-22)15-17-5-2-1-3-6-17/h1-12,16H,13-15H2/q+1