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3-methyl-6-nitro-3H-2-benzofuran-1-one

3-methyl-6-nitro-3H-2-benzofuran-1-one

Systemtic Name:3-methyl-6-nitro-3H-2-benzofuran-1-one
Openeye Name:3-methyl-6-nitro-3H-isobenzofuran-1-one
CAS Name:3-methyl-6-nitro-3H-isobenzofuran-1-one
IUPAC Name:3-methyl-6-nitro-3H-2-benzofuran-1-one
Traditional Name:3-methyl-6-nitro-phthalide
Formula: C9H7NO4
MolecularWeight: 193.15618
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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O1


Isomeric SMILES

CC1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O1


InChI

InChI=1S/C9H7NO4/c1-5-7-3-2-6(10(12)13)4-8(7)9(11)14-5/h2-5H,1H3


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