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5-ethyl-2-methyl-1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]pyridin-1-ium

5-ethyl-2-methyl-1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]pyridin-1-ium

Systemtic Name:5-ethyl-2-methyl-1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]pyridin-1-ium
Openeye Name:5-ethyl-2-methyl-1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]pyridin-1-ium
CAS Name:5-ethyl-2-methyl-1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]pyridin-1-ium
IUPAC Name:5-ethyl-2-methyl-1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]pyridin-1-ium
Traditional Name:5-ethyl-2-methyl-1-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]pyridin-1-ium
Formula: C17H19N2O4+
MolecularWeight: 315.34376
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C17H19N2O4/c1-3-13-5-4-12(2)18(8-13)9-14-6-16(19(20)21)7-15-10-22-11-23-17(14)15/h4-8H,3,9-11H2,1-2H3/q+1


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