8-chloranyl-5-(1-methylpyridin-1-ium-4-yl)-6,11-dihydrobenzo[c][1]benzazepine iodide

Systemtic Name: 8-chloranyl-5-(1-methylpyridin-1-ium-4-yl)-6,11-dihydrobenzo[c][1]benzazepine iodide Openeye Name: 8-chloro-5-(1-methylpyridin-1-ium-4-yl)-6,11-dihydrobenzo[c][1]benzazepine iodide CAS Name: 8-chloro-5-(1-methyl-4-pyridin-1-iumyl)-6,11-dihydrobenzo[c][1]benzazepine iodide IUPAC Name: 8-chloro-5-(1-methylpyridin-1-ium-4-yl)-6,11-dihydrobenzo[c][1]benzazepine iodide Traditional Name: 8-chloro-5-(1-methylpyridin-1-ium-4-yl)-6,11-dihydrobenzo[c][1]benzazepine iodide Formula: C20H18ClIN2 MolecularWeight: 448.72779

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)N2CC3=C(CC4=CC=CC=C42)C=CC(=C3)Cl.[I-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)N2CC3=C(CC4=CC=CC=C42)C=CC(=C3)Cl.[I-]

InChI

InChI=1S/C20H18ClN2.HI/c1-22-10-8-19(9-11-22)23-14-17-13-18(21)7-6-15(17)12-16-4-2-3-5-20(16)23;/h2-11,13H,12,14H2,1H3;1H/q+1;/p-1