4-(1,3-dioxolan-2-yl)-1-(3-phenylpropyl)pyridin-1-ium bromide

Systemtic Name: 4-(1,3-dioxolan-2-yl)-1-(3-phenylpropyl)pyridin-1-ium bromide Openeye Name: 4-(1,3-dioxolan-2-yl)-1-(3-phenylpropyl)pyridin-1-ium bromide CAS Name: 4-(1,3-dioxolan-2-yl)-1-(3-phenylpropyl)pyridin-1-ium bromide IUPAC Name: 4-(1,3-dioxolan-2-yl)-1-(3-phenylpropyl)pyridin-1-ium bromide Traditional Name: 4-(1,3-dioxolan-2-yl)-1-(3-phenylpropyl)pyridin-1-ium bromide Formula: C17H20BrNO2 MolecularWeight: 350.2502

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(O1)C2=CC=[N+](C=C2)CCCC3=CC=CC=C3.[Br-]

Isomeric SMILES

C1COC(O1)C2=CC=[N+](C=C2)CCCC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C17H20NO2.BrH/c1-2-5-15(6-3-1)7-4-10-18-11-8-16(9-12-18)17-19-13-14-20-17;/h1-3,5-6,8-9,11-12,17H,4,7,10,13-14H2;1H/q+1;/p-1