[2-(2-nitrooxyethylcarbamoyl)phenyl] thiophene-2-carboxylate

Systemtic Name: [2-(2-nitrooxyethylcarbamoyl)phenyl] thiophene-2-carboxylate Openeye Name: [2-(2-nitrooxyethylcarbamoyl)phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [2-[(2-nitrooxyethylamino)-oxomethyl]phenyl] ester IUPAC Name: [2-(2-nitrooxyethylcarbamoyl)phenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [2-(2-nitrooxyethylcarbamoyl)phenyl] ester Formula: C14H12N2O6S MolecularWeight: 336.31988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCCO[N+](=O)[O-])OC(=O)C2=CC=CS2

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCCO[N+](=O)[O-])OC(=O)C2=CC=CS2

InChI

InChI=1S/C14H12N2O6S/c17-13(15-7-8-21-16(19)20)10-4-1-2-5-11(10)22-14(18)12-6-3-9-23-12/h1-6,9H,7-8H2,(H,15,17)