(2-oxidanylidene-2-thiophen-2-yl-ethyl) 4-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 4-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 4-(tetrazol-1-yl)benzoate CAS Name: 4-(1-tetrazolyl)benzoic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 4-(tetrazol-1-yl)benzoate Traditional Name: 4-(tetrazol-1-yl)benzoic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C14H10N4O3S MolecularWeight: 314.3192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)COC(=O)C2=CC=C(C=C2)N3C=NN=N3

Isomeric SMILES

C1=CSC(=C1)C(=O)COC(=O)C2=CC=C(C=C2)N3C=NN=N3

InChI

InChI=1S/C14H10N4O3S/c19-12(13-2-1-7-22-13)8-21-14(20)10-3-5-11(6-4-10)18-9-15-16-17-18/h1-7,9H,8H2