5-(3,4-dihydro-2H-chromen-6-yl)-2-(1-methylpyridin-1-ium-4-yl)-1,3-oxazole

Systemtic Name: 5-(3,4-dihydro-2H-chromen-6-yl)-2-(1-methylpyridin-1-ium-4-yl)-1,3-oxazole Openeye Name: 5-chroman-6-yl-2-(1-methylpyridin-1-ium-4-yl)oxazole CAS Name: 5-(3,4-dihydro-2H-1-benzopyran-6-yl)-2-(1-methyl-4-pyridin-1-iumyl)oxazole IUPAC Name: 5-(3,4-dihydro-2H-chromen-6-yl)-2-(1-methylpyridin-1-ium-4-yl)-1,3-oxazole Traditional Name: 5-chroman-6-yl-2-(1-methylpyridin-1-ium-4-yl)oxazole Formula: C18H17N2O2+ MolecularWeight: 293.33978

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C2=NC=C(O2)C3=CC4=C(C=C3)OCCC4

Isomeric SMILES

C[N+]1=CC=C(C=C1)C2=NC=C(O2)C3=CC4=C(C=C3)OCCC4

InChI

InChI=1S/C18H17N2O2/c1-20-8-6-13(7-9-20)18-19-12-17(22-18)15-4-5-16-14(11-15)3-2-10-21-16/h4-9,11-12H,2-3,10H2,1H3/q+1