thiophen-2-ylmethyl 4-(2H-1,2,3,4-tetrazol-5-yl)benzoate

Systemtic Name: thiophen-2-ylmethyl 4-(2H-1,2,3,4-tetrazol-5-yl)benzoate Openeye Name: 2-thienylmethyl 4-(2H-tetrazol-5-yl)benzoate CAS Name: 4-(2H-tetrazol-5-yl)benzoic acid thiophen-2-ylmethyl ester IUPAC Name: thiophen-2-ylmethyl 4-(2H-tetrazol-5-yl)benzoate Traditional Name: 4-(2H-tetrazol-5-yl)benzoic acid 2-thenyl ester Formula: C13H10N4O2S MolecularWeight: 286.3091

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)COC(=O)C2=CC=C(C=C2)C3=NNN=N3

Isomeric SMILES

C1=CSC(=C1)COC(=O)C2=CC=C(C=C2)C3=NNN=N3

InChI

InChI=1S/C13H10N4O2S/c18-13(19-8-11-2-1-7-20-11)10-5-3-9(4-6-10)12-14-16-17-15-12/h1-7H,8H2,(H,14,15,16,17)