[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 3-nitrobenzoate

Systemtic Name: [2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 3-nitrobenzoate Openeye Name: [2-oxo-2-[2-(2-thienyl)ethylamino]ethyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-keto-2-[2-(2-thienyl)ethylamino]ethyl] ester Formula: C15H14N2O5S MolecularWeight: 334.34706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NCCC2=CC=CS2

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NCCC2=CC=CS2

InChI

InChI=1S/C15H14N2O5S/c18-14(16-7-6-13-5-2-8-23-13)10-22-15(19)11-3-1-4-12(9-11)17(20)21/h1-5,8-9H,6-7,10H2,(H,16,18)