[3-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]methanamine iodide

Systemtic Name: [3-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]methanamine iodide Openeye Name: [3-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]methanamine iodide CAS Name: [3-(3,3-diphenylpropyl)-1-pyridin-1-iumyl]methanamine iodide IUPAC Name: [3-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]methanamine iodide Traditional Name: [3-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]methylamine iodide Formula: C21H23IN2 MolecularWeight: 430.32519

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCC2=C[N+](=CC=C2)CN)C3=CC=CC=C3.[I-]

Isomeric SMILES

C1=CC=C(C=C1)C(CCC2=C[N+](=CC=C2)CN)C3=CC=CC=C3.[I-]

InChI

InChI=1S/C21H23N2.HI/c22-17-23-15-7-8-18(16-23)13-14-21(19-9-3-1-4-10-19)20-11-5-2-6-12-20;/h1-12,15-16,21H,13-14,17,22H2;1H/q+1;/p-1