(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 3-cyanobenzoate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 3-cyanobenzoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C16H10N2O3S MolecularWeight: 310.3272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)OCC2=NOC(=C2)C3=CC=CS3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)OCC2=NOC(=C2)C3=CC=CS3)C#N

InChI

InChI=1S/C16H10N2O3S/c17-9-11-3-1-4-12(7-11)16(19)20-10-13-8-14(21-18-13)15-5-2-6-22-15/h1-8H,10H2