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6-nitro-2-propyl-4H-1,3-benzoxathiine

6-nitro-2-propyl-4H-1,3-benzoxathiine

Systemtic Name:6-nitro-2-propyl-4H-1,3-benzoxathiine
Openeye Name:6-nitro-2-propyl-4H-1,3-benzoxathiine
CAS Name:6-nitro-2-propyl-4H-1,3-benzoxathiin
IUPAC Name:6-nitro-2-propyl-4H-1,3-benzoxathiine
Traditional Name:6-nitro-2-propyl-4H-1,3-benzoxathiin
Formula: C11H13NO3S
MolecularWeight: 239.29082
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Descriptors Computed from Structure

Canonical SMILES:

CCCC1OC2=C(CS1)C=C(C=C2)[N+](=O)[O-]


Isomeric SMILES

CCCC1OC2=C(CS1)C=C(C=C2)[N+](=O)[O-]


InChI

InChI=1S/C11H13NO3S/c1-2-3-11-15-10-5-4-9(12(13)14)6-8(10)7-16-11/h4-6,11H,2-3,7H2,1H3


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