4-chloranyl-N-[1-[2-(1H-indol-3-yl)ethyl]pyridin-1-ium-4-yl]benzamide bromide

Systemtic Name: 4-chloranyl-N-[1-[2-(1H-indol-3-yl)ethyl]pyridin-1-ium-4-yl]benzamide bromide Openeye Name: 4-chloro-N-[1-[2-(1H-indol-3-yl)ethyl]pyridin-1-ium-4-yl]benzamide bromide CAS Name: 4-chloro-N-[1-[2-(1H-indol-3-yl)ethyl]-4-pyridin-1-iumyl]benzamide bromide IUPAC Name: 4-chloro-N-[1-[2-(1H-indol-3-yl)ethyl]pyridin-1-ium-4-yl]benzamide bromide Traditional Name: 4-chloro-N-[1-[2-(1H-indol-3-yl)ethyl]pyridin-1-ium-4-yl]benzamide bromide Formula: C22H19BrClN3O MolecularWeight: 456.76276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC[N+]3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)Cl.[Br-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC[N+]3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)Cl.[Br-]

InChI

InChI=1S/C22H18ClN3O.BrH/c23-18-7-5-16(6-8-18)22(27)25-19-10-13-26(14-11-19)12-9-17-15-24-21-4-2-1-3-20(17)21;/h1-8,10-11,13-15,24H,9,12H2;1H