11-methyl-11-[(E)-prop-1-enyl]-5,6-dihydrobenzo[b][1]benzazepin-11-ium iodide

Systemtic Name: 11-methyl-11-[(E)-prop-1-enyl]-5,6-dihydrobenzo[b][1]benzazepin-11-ium iodide Openeye Name: 11-methyl-11-[(E)-prop-1-enyl]-5,6-dihydrobenzo[b][1]benzazepin-11-ium iodide CAS Name: 11-methyl-11-[(E)-prop-1-enyl]-5,6-dihydrobenzo[b][1]benzazepin-11-ium iodide IUPAC Name: 11-methyl-11-[(E)-prop-1-enyl]-5,6-dihydrobenzo[b][1]benzazepin-11-ium iodide Traditional Name: 11-methyl-11-[(E)-prop-1-enyl]-5,6-dihydrobenzo[b][1]benzazepin-11-ium iodide Formula: C18H20IN MolecularWeight: 377.26257

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Descriptors Computed from Structure

Canonical SMILES:

CC=C[N+]1(C2=CC=CC=C2CCC3=CC=CC=C31)C.[I-]

Isomeric SMILES

C/C=C/[N+]1(C2=CC=CC=C2CCC3=CC=CC=C31)C.[I-]

InChI

InChI=1S/C18H20N.HI/c1-3-14-19(2)17-10-6-4-8-15(17)12-13-16-9-5-7-11-18(16)19;/h3-11,14H,12-13H2,1-2H3;1H/q+1;/p-1/b14-3+;