2-(6-methyl-5,7-dihydrobenzo[d][2]benzazepin-6-ium-6-yl)-1-phenyl-propan-1-ol iodide

Systemtic Name: 2-(6-methyl-5,7-dihydrobenzo[d][2]benzazepin-6-ium-6-yl)-1-phenyl-propan-1-ol iodide Openeye Name: 2-(6-methyl-5,7-dihydrobenzo[d][2]benzazepin-6-ium-6-yl)-1-phenyl-propan-1-ol iodide CAS Name: 2-(6-methyl-5,7-dihydrobenzo[d][2]benzazepin-6-ium-6-yl)-1-phenyl-1-propanol iodide IUPAC Name: 2-(6-methyl-5,7-dihydrobenzo[d][2]benzazepin-6-ium-6-yl)-1-phenylpropan-1-ol iodide Traditional Name: 2-(6-methyl-5,7-dihydrobenzo[d][2]benzazepin-6-ium-6-yl)-1-phenyl-propan-1-ol iodide Formula: C24H26INO MolecularWeight: 471.37381

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)O)[N+]2(CC3=CC=CC=C3C4=CC=CC=C4C2)C.[I-]

Isomeric SMILES

CC(C(C1=CC=CC=C1)O)[N+]2(CC3=CC=CC=C3C4=CC=CC=C4C2)C.[I-]

InChI

InChI=1S/C24H26NO.HI/c1-18(24(26)19-10-4-3-5-11-19)25(2)16-20-12-6-8-14-22(20)23-15-9-7-13-21(23)17-25;/h3-15,18,24,26H,16-17H2,1-2H3;1H/q+1;/p-1