2-(phenylcarbonyloxy)ethyl 5-nitrothiophene-2-carboxylate

Systemtic Name: 2-(phenylcarbonyloxy)ethyl 5-nitrothiophene-2-carboxylate Openeye Name: 2-benzoyloxyethyl 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid 2-benzoyloxyethyl ester IUPAC Name: 2-benzoyloxyethyl 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid 2-benzoyloxyethyl ester Formula: C14H11NO6S MolecularWeight: 321.30524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCOC(=O)C2=CC=C(S2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCOC(=O)C2=CC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C14H11NO6S/c16-13(10-4-2-1-3-5-10)20-8-9-21-14(17)11-6-7-12(22-11)15(18)19/h1-7H,8-9H2