[4-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]methanamine iodide

Systemtic Name: [4-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]methanamine iodide Openeye Name: [4-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]methanamine iodide CAS Name: [4-(3,3-diphenylpropyl)-1-pyridin-1-iumyl]methanamine iodide IUPAC Name: [4-(3,3-diphenylpropyl)pyridin-1-ium-1-yl]methanamine iodide Traditional Name: [4-(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=CC=[N+](C=C2)CN)C3=CC=CC=C3.[I-]

Isomeric SMILES

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

InChI

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