5-bromanyl-3-[2-(2,4,6-triphenylpyridin-1-ium-1-yl)ethyl]-1H-indole

Systemtic Name: 5-bromanyl-3-[2-(2,4,6-triphenylpyridin-1-ium-1-yl)ethyl]-1H-indole Openeye Name: 5-bromo-3-[2-(2,4,6-triphenylpyridin-1-ium-1-yl)ethyl]-1H-indole CAS Name: 5-bromo-3-[2-(2,4,6-triphenyl-1-pyridin-1-iumyl)ethyl]-1H-indole IUPAC Name: 5-bromo-3-[2-(2,4,6-triphenylpyridin-1-ium-1-yl)ethyl]-1H-indole Traditional Name: 5-bromo-3-[2-(2,4,6-triphenylpyridin-1-ium-1-yl)ethyl]-1H-indole Formula: C33H26BrN2+ MolecularWeight: 530.47694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3)CCC4=CNC5=C4C=C(C=C5)Br)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3)CCC4=CNC5=C4C=C(C=C5)Br)C6=CC=CC=C6

InChI

InChI=1S/C33H26BrN2/c34-29-16-17-31-30(22-29)27(23-35-31)18-19-36-32(25-12-6-2-7-13-25)20-28(24-10-4-1-5-11-24)21-33(36)26-14-8-3-9-15-26/h1-17,20-23,35H,18-19H2/q+1