(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 4-(tetrazol-1-yl)benzoate CAS Name: 4-(1-tetrazolyl)benzoic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-(tetrazol-1-yl)benzoate Traditional Name: 4-(tetrazol-1-yl)benzoic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C16H11N5O3S MolecularWeight: 353.35524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC(=NO2)COC(=O)C3=CC=C(C=C3)N4C=NN=N4

Isomeric SMILES

C1=CSC(=C1)C2=CC(=NO2)COC(=O)C3=CC=C(C=C3)N4C=NN=N4

InChI

InChI=1S/C16H11N5O3S/c22-16(11-3-5-13(6-4-11)21-10-17-19-20-21)23-9-12-8-14(24-18-12)15-2-1-7-25-15/h1-8,10H,9H2