2-methoxyethyl 5-nitro-1-benzothiophene-2-carboxylate

Systemtic Name: 2-methoxyethyl 5-nitro-1-benzothiophene-2-carboxylate Openeye Name: 2-methoxyethyl 5-nitrobenzothiophene-2-carboxylate CAS Name: 5-nitro-1-benzothiophene-2-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 5-nitro-1-benzothiophene-2-carboxylate Traditional Name: 5-nitrobenzothiophene-2-carboxylic acid 2-methoxyethyl ester Formula: C12H11NO5S MolecularWeight: 281.28444

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C1=CC2=C(S1)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

COCCOC(=O)C1=CC2=C(S1)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H11NO5S/c1-17-4-5-18-12(14)11-7-8-6-9(13(15)16)2-3-10(8)19-11/h2-3,6-7H,4-5H2,1H3