[2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl] 2-nitrobenzoate

Systemtic Name: [2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl] 2-nitrobenzoate Openeye Name: [2-(5-chloro-2-thienyl)-2-oxo-ethyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [2-(5-chloro-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-chlorothiophen-2-yl)-2-oxoethyl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [2-(5-chloro-2-thienyl)-2-keto-ethyl] ester Formula: C13H8ClNO5S MolecularWeight: 325.72432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H8ClNO5S/c14-12-6-5-11(21-12)10(16)7-20-13(17)8-3-1-2-4-9(8)15(18)19/h1-6H,7H2