1-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl]-4-ethyl-pyridin-1-ium

Systemtic Name: 1-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl]-4-ethyl-pyridin-1-ium Openeye Name: 1-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-4-ethyl-pyridin-1-ium CAS Name: 1-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-4-ethylpyridin-1-ium IUPAC Name: 1-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-4-ethylpyridin-1-ium Traditional Name: 1-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-4-ethyl-pyridin-1-ium Formula: C16H17ClNO2+ MolecularWeight: 290.76468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=[N+](C=C1)CC2=C3C(=CC(=C2)Cl)COCO3

Isomeric SMILES

CCC1=CC=[N+](C=C1)CC2=C3C(=CC(=C2)Cl)COCO3

InChI

InChI=1S/C16H17ClNO2/c1-2-12-3-5-18(6-4-12)9-13-7-15(17)8-14-10-19-11-20-16(13)14/h3-8H,2,9-11H2,1H3/q+1