3-ethoxy-5-nitro-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-ethoxy-5-nitro-1-benzothiophene-2-carboxylic acid Openeye Name: 3-ethoxy-5-nitro-benzothiophene-2-carboxylic acid CAS Name: 3-ethoxy-5-nitro-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-ethoxy-5-nitro-1-benzothiophene-2-carboxylic acid Traditional Name: 3-ethoxy-5-nitro-benzothiophene-2-carboxylic acid Formula: C11H9NO5S MolecularWeight: 267.25786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(SC2=C1C=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCOC1=C(SC2=C1C=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H9NO5S/c1-2-17-9-7-5-6(12(15)16)3-4-8(7)18-10(9)11(13)14/h3-5H,2H2,1H3,(H,13,14)