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2-[(3,5-dinitrophenoxy)methyl]-4-propan-2-yl-1,3-thiazole

2-[(3,5-dinitrophenoxy)methyl]-4-propan-2-yl-1,3-thiazole

Systemtic Name:2-[(3,5-dinitrophenoxy)methyl]-4-propan-2-yl-1,3-thiazole
Openeye Name:2-[(3,5-dinitrophenoxy)methyl]-4-isopropyl-thiazole
CAS Name:2-[(3,5-dinitrophenoxy)methyl]-4-propan-2-ylthiazole
IUPAC Name:2-[(3,5-dinitrophenoxy)methyl]-4-propan-2-yl-1,3-thiazole
Traditional Name:2-[(3,5-dinitrophenoxy)methyl]-4-isopropyl-thiazole
Formula: C13H13N3O5S
MolecularWeight: 323.32442
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CSC(=N1)COC2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

CC(C)C1=CSC(=N1)COC2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C13H13N3O5S/c1-8(2)12-7-22-13(14-12)6-21-11-4-9(15(17)18)3-10(5-11)16(19)20/h3-5,7-8H,6H2,1-2H3


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